![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) Siffar Hoton](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)
Lambar Rijistar CAS
199593-09-4
| Mabuɗin Abubuwan Jiki | Daraja | Sharadi |
| Nauyin Kwayoyin Halitta | 801.87 | - |
| pKa (An annabta) | 10.18± 0.20 | Mafi yawan zafin jiki: 25 ° C |
MURMUSHI na Canonical
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
MURMUSHI
C(OC[C@H] 1[C@@H](OP(N(C)C)C(C)C)OCCC#N 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
InChi Key
WNWUMIPFLOKTEZ-UAQIPLLRSA-N
1 Wani Sunan Wannan Abu
Cytidine,N-Acetyl-5'-O- [bis (4-methoxyphenyl) phenylmethyl]-2′-O-methyl-, 3′- [2-cyanoethyl bis (1-methylethyl) phosphoramite] (9CI)
Properties akwai
Halittu
Chemical
Lipinski
Tsarin Yanayi
| Dukiya | Daraja | Sharadi | Source |
| Factor na Bioconcentration | 4.77 | pH da 1; Zazzabi: 25 ° C | (1) ACD |
| Factor na Bioconcentration | 50.1 | pH da 2; Zazzabi: 25 ° C | (1) ACD |
| Factor na Bioconcentration | 2190 | pH da 3; Zazzabi: 25 ° C | (1) ACD |
| Factor na Bioconcentration | 21700 | pH da 4; Zazzabi: 25 ° C | (1) ACD |
| Factor na Bioconcentration | 35700 | pH da 5; Zazzabi: 25 ° C | (1) ACD |
| Factor na Bioconcentration | 37800 | pH da 6; Zazzabi: 25 ° C | (1) ACD |
| Factor na Bioconcentration | 37900 | pH da 7; Zazzabi: 25 ° C | (1) ACD |
| Factor na Bioconcentration | 37300 | pH da 8; Zazzabi: 25 ° C | (1) ACD |
| Factor na Bioconcentration | 31400 | pH da 9; Zazzabi: 25 ° C | (1) ACD |
| Factor na Bioconcentration | 12300 | pH 10; Zazzabi: 25 ° C | (1) ACD |
(1) An ƙididdige ta ta amfani da Ci gaban Chemistry na Babba (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
| Tushen Halin Ƙimar Dukiya |
| Koc 8.29 pH 1; Zazzabi: 25 °C (1) ACD |
| Koc 87.1 pH 2; Zazzabi: 25 °C (1) ACD |
| Koc 3800 pH 3; Zazzabi: 25 °C (1) ACD |
| Koc 37700 pH 4; Zazzabi: 25 °C (1) ACD |
| Koc 62000 pH 5; Zazzabi: 25 °C (1) ACD |
| Koc 65700 pH 6; Zazzabi: 25 °C (1) ACD |
| Koc 65900 pH 7; Zazzabi: 25 °C (1) ACD |
| Koc 64700 pH 8; Zazzabi: 25 °C (1) ACD |
| Koc 54500 pH 9; Zazzabi: 25 °C (1) ACD |
| Koc 21400 pH 10; Zazzabi: 25 ° C (1) ACD |
| logD 2.43 pH 1; Zazzabi: 25 °C (1) ACD |
| logD 3.45 pH 2; Zazzabi: 25 °C (1) ACD |
| logD 5.09 pH 3; Zazzabi: 25 °C (1) ACD |
| Dukiya | Daraja | Sharadi | Source |
| logD | 6.09 | pH da 4; Zazzabi: 25 ° C | (1) ACD |
| logD | 6.30 | pH da 5; Zazzabi: 25 ° C | (1) ACD |
| logD | 6.33 | pH da 6; Zazzabi: 25 ° C | (1) ACD |
| logD | 6.33 | pH da 7; Zazzabi: 25 ° C | (1) ACD |
| logD | 6.32 | pH da 8; Zazzabi: 25 ° C | (1) ACD |
| logD | 6.25 | pH da 9; Zazzabi: 25 ° C | (1) ACD |
| logD | 5.84 | pH 10; Zazzabi: 25 ° C | (1) ACD |
| logP | 6.329± 0.771 | Zazzabi: 25 ° C | (1) ACD |
| Mass Intrinsic Solubility | 1.8 x 10-4 g/L | Zazzabi: 25 ° C | (1) ACD |
| Mass Solubility | 1.4 g/L | pH da 1; Zazzabi: 25 ° C | (1) ACD |
| Mass Solubility | 0.14 g/L | pH da 2; Zazzabi: 25 ° C | (1) ACD |
| Mass Solubility | 3.1 x 10-3 g/L | pH da 3; Zazzabi: 25 ° C | (1) ACD |
| Mass Solubility | 3.2 x 10-4 g/L | pH da 4; Zazzabi: 25 ° C | (1) ACD |
| Mass Solubility | 1.9 x 10-4 g/L | pH da 5; Zazzabi: 25 ° C | (1) ACD |
| Mass Solubility | 1.8 x 10-4 g/L | pH da 6; Zazzabi: 25 ° C | (1) ACD |
| Mass Solubility | 1.8 x 10-4 g/L | pH da 7; Zazzabi: 25 ° C | (1) ACD |
| Mass Solubility | 1.8 x 10-4 g/L | pH da 8; Zazzabi: 25 ° C | (1) ACD |
| Mass Solubility | 2.2 x 10-4 g/L | pH da 9; Zazzabi: 25 ° C | (1) ACD |
| Mass Solubility | 5.6 x 10-4 g/L | pH 10; Zazzabi: 25 ° C | (1) ACD |
| Mass Solubility | 1.8 x 10-4 g/L | Ruwan da ba a buƙata ba pH 7.00; Zazzabi: 25 ° C | (1) ACD |
| Solubility na Ciki na Molar | 2.3 x 10-7 mol/L | Zazzabi: 25 ° C | (1) ACD |
| Solubility na Molar | 1.8 x 10-3 mol/L | pH da 1; Zazzabi: 25 ° C | (1) ACD |
| Solubility na Molar | 1.7 x 10-4 mol/L | pH da 2; Zazzabi: 25 ° C | (1) ACD |
| Solubility na Molar | 3.9 x 10-6 mol/L | pH da 3; Zazzabi: 25 ° C | (1) ACD |
| Solubility na Molar | 4.0 x 10-7 mol/L | pH da 4; Zazzabi: 25 ° C | (1) ACD |
| Solubility na Molar | 2.4 x 10-7 mol/L | pH da 5; Zazzabi: 25 ° C | (1) ACD |
| Solubility na Molar | 2.3 x 10-7 mol/L | pH da 6; Zazzabi: 25 ° C | (1) ACD |
| Solubility na Molar | 2.3 x 10-7 mol/L | pH da 7; Zazzabi: 25 ° C | (1) ACD |
| Solubility na Molar | 2.3 x 10-7 mol/L | pH da 8; Zazzabi: 25 ° C | (1) ACD |
| Solubility na Molar | 2.8 x 10-7 mol/L | pH da 9; Zazzabi: 25 ° C | (1) ACD |
| Solubility na Molar | 7.0 x 10-7 mol/L | pH 10; Zazzabi: 25 ° C | (1) ACD |
| Solubility na Molar | 2.3 x 10-7 mol/L | Ruwan da ba a buƙata ba pH 7.00; Zazzabi: 25 ° C | (1) ACD |
| Dukiya | Daraja | Sharadi | Source |
| Nauyin Kwayoyin Halitta | 801.87 | ||
| pKa | 10.18± 0.20 | Mafi yawan zafin jiki: 25 ° C | (1) ACD |
| pKa | 3.57± 0.20 | Mafi Asalin Zazzabi: 25 ° C | (1) ACD |
(1) An ƙididdige ta ta amfani da Ci gaban Chemistry na Babba (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
| Dukiya | Daraja | Sharadi | Source |
| Ƙimar Rarraba Kyauta | 18 | (1) ACD | |
| H Masu karɓa | 14 | (1) ACD | |
| H Masu Ba da taimako | 1 | (1) ACD | |
| H Donor/Acceptor Sum | 15 | (1) ACD | |
| logP | 6.329± 0.771 | Zazzabi: 25 ° C | (1) ACD |
| Nauyin Kwayoyin Halitta | 801.87 |
(1) An ƙididdige ta ta amfani da Ci gaban Chemistry na Babba (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
| Dukiya | Daraja | Tushen yanayi |
| Wuri Mai Girma | 167 A2 | (1) ACD |
(1) An ƙididdige ta ta amfani da Ci gaban Chemistry na Babba (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
Spectra akwai
1H NMR
13C NMR
![C48H54N7O8P Adenosine, N-benzoyl-5′-O- [bis (4-methoxyphenyl) phenylmethyl]-2′-O-methyl-, 3′ – [2-cyanoethyl N, N-bis (1-methylethyl) phospho amidite] (ACI)](https://www.csnvchem.com/uploads/C48H54N7O8P-300x300.png)
![C47H51FN7O7P Adenosine, N-benzoyl-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/C47H51FN7O7P-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)
![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)
![C43H55N4O10P Uridine, 5'-O- [bis (4-methoxyphenyl) phenylmethyl] -2'-O- (2-methox yethyl) - 5-methyl-, 3'- [2-cyanoethyl N, N-bis (1-) methylethyl phosphor amidite (ACI)](https://www.csnvchem.com/uploads/C43H55N4O10P-Uridine-300x300.png)