![C42H52N5O9P Cytidine, N-acetyl-5′ -O- [bis(4-methoxyphenyl)phenylmethyl]-2′ -O- methyl-, 3′ – [2-cyanoethyl N,N-bis(1-methylethyl)phosphoramidite] ( ACI)](http://cdn.globalso.com/nvchem/style/global/img/demo/page_banner.jpg)
![C42H52N5O9P Cytidine, N-acetyl-5′ -O- [bis(4-methoxyphenyl)phenylmethyl]-2′ -O- methyl-, 3′ – [2-cyanoethyl N,N-bis(1-methylethyl)phosphoramidite] ( ACI) Setšoantšo se hlahang](https://www.csnvchem.com/uploads/C42H52N5O9P-Cytidine.png)
C42H52N5O9P Cytidine, N-acetyl-5′ -O- [bis(4-methoxyphenyl)phenylmethyl]-2′ -O- methyl-, 3′ – [2-cyanoethyl N,N-bis(1-methylethyl)phosphoramidite] ( ACI)
Nomoro ea Registry ea CAS
199593-09-4
| Lintho Tsa Bohlokoa Tsa 'Mele | Boleng | Boemo |
| Boima ba Molek'hule | 801.87 | - |
| pKa (E boletsoeng esale pele) | 10.18±0,20 | Mocheso o nang le Asiti ka ho Fetisisa: 25 °C |
Canonical POSISO
N#CCCOP(OC1C(OC(N2C=CC(= NC2=O)NC(=O)C)C1OC)COC(C=3C=CC=CC3)(C4=CC=C(OC)C=C4)C5 =CC=C(OC)C=C5)N(C(C)C)C(C)C
Isomeric SOSOA
C(OC[C@@H]1[C@@H](OP(N(C(C)C)C(C)C)OCCC#N)[C@@H](OC)[C@@ H](O1)N2C(=O)N=C(NC(C)=O)C=C2)(C3=CC=C(OC)C=C3)(C4=CC =C(OC)C=C4)C5=CC=CC=C5
InChi
InChI= 1S/C42H52N5O9P/c1-28(2)47(29(3)4)57(54-26-12-24-43)56-38-36(55-40(39(38)52-8)46- 25-23-37(44-30(5)48)45-41(46)49)27-53 -42(31-13-10-9-11-14-31,32-15-19-34(50-6)20-16-32)33-17-21-35( 51-7)22-18-33/h9-11,13-23,25,28-29,36,38-40H,12,26-27H2,1-8H3,( H,44,45,48,49)/t36-,38-,39-,40-,57?/m1/s1
Senotlolo sa InChi
WNWUMIPFLOKTEZ-UAQIPLLRSA-N
1 Lebitso le Leng la Ntho ena
Cytidine,Nacetyl-5′ -O- [bis(4-methoxyphenyl)phenylmethyl]-2′ -O-methyl-, 3′ - [2-cyanoethyl bis(1-methylethyl)phosphoramidite] (9CI)
Thepa e teng
Likokoana-hloko
Lik'hemik'hale
Lipinski
Sebopeho se Amanang
| Thepa | Boleng | Boemo | Mohloli |
| Bioconcentration Factor | 4.77 | pH 1; Mocheso: 25 °C | (1) ACD |
| Bioconcentration Factor | 50.1 | pH 2; Mocheso: 25 °C | (1) ACD |
| Bioconcentration Factor | 2190 | pH 3; Mocheso: 25 °C | (1) ACD |
| Bioconcentration Factor | 21700 | pH 4; Mocheso: 25 °C | (1) ACD |
| Bioconcentration Factor | 35700 | pH 5; Mocheso: 25 °C | (1) ACD |
| Bioconcentration Factor | 37800 | pH 6; Mocheso: 25 °C | (1) ACD |
| Bioconcentration Factor | 37900 | pH 7; Mocheso: 25 °C | (1) ACD |
| Bioconcentration Factor | 37300 | pH 8; Mocheso: 25 °C | (1) ACD |
| Bioconcentration Factor | 31400 | pH 9; Mocheso: 25 °C | (1) ACD |
| Bioconcentration Factor | 12300 | pH 10; Mocheso: 25 °C | (1) ACD |
(1) E baloang ho sebelisoa Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
| Mohloli oa Boemo ba Boleng ba Thepa |
| Koc 8.29 pH 1; Mocheso: 25 °C (1) ACD |
| Koc 87.1 pH 2; Mocheso: 25 °C (1) ACD |
| Koc 3800 pH 3; Mocheso: 25 °C (1) ACD |
| Koc 37700 pH 4; Mocheso: 25 °C (1) ACD |
| Koc 62000 pH 5; Mocheso: 25 °C (1) ACD |
| Koc 65700 pH 6; Mocheso: 25 °C (1) ACD |
| Koc 65900 pH 7; Mocheso: 25 °C (1) ACD |
| Koc 64700 pH 8; Mocheso: 25 °C (1) ACD |
| Koc 54500 pH 9; Mocheso: 25 °C (1) ACD |
| Koc 21400 pH 10; Mocheso: 25 °C (1) ACD |
| logD 2.43 pH 1; Mocheso: 25 °C (1) ACD |
| logD 3.45 pH 2; Mocheso: 25 °C (1) ACD |
| logD 5.09 pH 3; Mocheso: 25 °C (1) ACD |
| Thepa | Boleng | Boemo | Mohloli |
| logD | 6.09 | pH 4; Mocheso: 25 °C | (1) ACD |
| logD | 6.30 | pH 5; Mocheso: 25 °C | (1) ACD |
| logD | 6.33 | pH 6; Mocheso: 25 °C | (1) ACD |
| logD | 6.33 | pH 7; Mocheso: 25 °C | (1) ACD |
| logD | 6.32 | pH 8; Mocheso: 25 °C | (1) ACD |
| logD | 6.25 | pH 9; Mocheso: 25 °C | (1) ACD |
| logD | 5.84 | pH 10; Mocheso: 25 °C | (1) ACD |
| logP | 6.329±0.771 | Mocheso: 25 °C | (1) ACD |
| Mass Intrinsic Sollubility | 1.8 x 10-4 g/L | Mocheso: 25 °C | (1) ACD |
| Ho qhibiliha ka bongata | 1.4 g/L | pH 1; Mocheso: 25 °C | (1) ACD |
| Ho qhibiliha ka bongata | 0.14 g/L | pH 2; Mocheso: 25 °C | (1) ACD |
| Ho qhibiliha ka bongata | 3.1 x 10-3 g/L | pH 3; Mocheso: 25 °C | (1) ACD |
| Ho qhibiliha ka bongata | 3.2 x 10-4 g/L | pH 4; Mocheso: 25 °C | (1) ACD |
| Ho qhibiliha ka bongata | 1.9 x 10-4 g/L | pH 5; Mocheso: 25 °C | (1) ACD |
| Ho qhibiliha ka bongata | 1.8 x 10-4 g/L | pH 6; Mocheso: 25 °C | (1) ACD |
| Ho qhibiliha ka bongata | 1.8 x 10-4 g/L | pH 7; Mocheso: 25 °C | (1) ACD |
| Ho qhibiliha ka bongata | 1.8 x 10-4 g/L | pH 8; Mocheso: 25 °C | (1) ACD |
| Ho qhibiliha ka bongata | 2.2 x 10-4 g/L | pH 9; Mocheso: 25 °C | (1) ACD |
| Ho qhibiliha ka bongata | 5.6 x 10-4 g/L | pH 10; Mocheso: 25 °C | (1) ACD |
| Ho qhibiliha ka bongata | 1.8 x 10-4 g/L | Metsi a sa tsitsang pH 7.00; Mocheso: 25 °C | (1) ACD |
| Molar Intrinsic Solubility | 2.3 x 10-7 mol/L | Mocheso: 25 °C | (1) ACD |
| Molar Solubility | 1.8 x 10-3 mol/L | pH 1; Mocheso: 25 °C | (1) ACD |
| Molar Solubility | 1.7 x 10-4 mol/L | pH 2; Mocheso: 25 °C | (1) ACD |
| Molar Solubility | 3.9 x 10-6 mol/L | pH 3; Mocheso: 25 °C | (1) ACD |
| Molar Solubility | 4.0 x 10-7 mol/L | pH 4; Mocheso: 25 °C | (1) ACD |
| Molar Solubility | 2.4 x 10-7 mol/L | pH 5; Mocheso: 25 °C | (1) ACD |
| Molar Solubility | 2.3 x 10-7 mol/L | pH 6; Mocheso: 25 °C | (1) ACD |
| Molar Solubility | 2.3 x 10-7 mol/L | pH 7; Mocheso: 25 °C | (1) ACD |
| Molar Solubility | 2.3 x 10-7 mol/L | pH 8; Mocheso: 25 °C | (1) ACD |
| Molar Solubility | 2.8 x 10-7 mol/L | pH 9; Mocheso: 25 °C | (1) ACD |
| Molar Solubility | 7.0 x 10-7 mol/L | pH 10; Mocheso: 25 °C | (1) ACD |
| Molar Solubility | 2.3 x 10-7 mol/L | Metsi a sa tsitsang pH 7.00; Mocheso: 25 °C | (1) ACD |
| Thepa | Boleng | Boemo | Mohloli |
| Boima ba Molek'hule | 801.87 | ||
| pKa | 10.18±0,20 | Mocheso o nang le Asiti ka ho Fetisisa: 25 °C | (1) ACD |
| pKa | 3.57±0,20 | Mocheso ka ho Fetisisa oa Motheo: 25 °C | (1) ACD |
(1) E baloang ho sebelisoa Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
| Thepa | Boleng | Boemo | Mohloli |
| Li-Bonds tse ka fetolehang ka bolokolohi | 18 | (1) ACD | |
| H Ba amohelang | 14 | (1) ACD | |
| H Bafani | 1 | (1) ACD | |
| H Kakaretso ea Mofani/Moamoheli | 15 | (1) ACD | |
| logP | 6.329±0.771 | Mocheso: 25 °C | (1) ACD |
| Boima ba Molek'hule | 801.87 |
(1) E baloang ho sebelisoa Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
| Thepa | Boleng | Mohloli oa Boemo |
| Sebaka sa Polar Surface | 167 A2 | (1) ACD |
(1) E baloang ho sebelisoa Advanced Chemistry Development (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
Spectra e fumaneha
1H NMR
13C NMR
![C40H49N4O9P Uridine, 5′ -O- [bis(4-methoxyphenyl)phenylmethyl]-2′ -O-methyl-, 3′ – [2-cyanoethyl N,N-bis(1-methylethyl)phosphoramidite] (ACI)](https://www.csnvchem.com/uploads/C40H49N4O9P-Uridine-300x300.png)
![C50H60N5O10P Cytidine, N-benzoyl-5′ -O- [bis(4-methoxyphenyl)phenylmethyl]-2′ -O- (2-methoxyethyl)- 5-methyl-, 3′ – [2-cyanoethyl N,N-bis (1-methylethyl) phosphoramidite] (ACI)](https://www.csnvchem.com/uploads/C50H60N5O10P-Cytidine-300x300.png)
![C50H58N7O9P Adenosine, N-benzoyl-5′ -O- [bis(4-methoxyphenyl)phenylmethyl]-2′ – O-(2-methoxyethyl)-, 3′ – [2-cyanoethyl N,N-bis(1-methylethyl) phosphoramidite] (ACI)](https://www.csnvchem.com/uploads/C50H58N7O9P-Adenosine-300x300.png)
![C41H49FN5O8P Cytidine, N-acetyl-5′ -O- [bis(4-methoxyphenyl)phenylmethyl]-2′ – deoxy-2′ -fluoro-, 3′ – [2-cyanoethyl N,N-bis(1-methylethyl) phosphor amidite] (ACI)](https://www.csnvchem.com/uploads/C41H49FN5O8P-Cytidine-300x300.png)
![C45H56N7O9P Guanosine, 5′ -O- [bis(4-methoxyphenyl)phenylmethyl]-2′ -O-methyl- N-(2-methyl-1-oxopropyl)-, 3′ – [2-cyanoethyl N,N-bis (1-methylethyl) phosphoramidite] (ACI)](https://www.csnvchem.com/uploads/C45H56N7O9P-300x300.png)
![C39H46FN4O8P Uridine, 5′ -O- [bis(4-methoxyphenyl)phenylmethyl]-2′ -deoxy-2′ – fluoro-, 3′ – [2-cyanoethyl N,N-bis(1-methylethyl)phosphoramidite] (ACI )](https://www.csnvchem.com/uploads/C39H46FN4O8P-Uridine-300x300.png)