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)
Lambar Rijistar CAS
163878-63-5
H302
Mabuɗin Abubuwan Jiki | Daraja | Yanayi |
Nauyin Kwayoyin Halitta | 818.89 | - |
pKa (An annabta) | 9.55± 0.10 | Mafi yawan zafin jiki: 25 ° C |
MURMUSHI na Canonical
N#CCCOP(OC1C(OC(N2C=C(C(=O)) NC2=O)C)C1OCCOC)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)NC(=O)C(C)=C2)(C3=CC=C(OC)C=C3)(C4=CC) =C(OC)C=C4)C5=CC=CC=C5
InChi
InChi= 1S/C43H55N4O10P/c1-29(2)47(30(3)4)58(55-24-12-23-44)57-38-37(56-41(39(38)53-26-25- 50-6) 46-27-31 (5)40 (48) 45-42 (46)49)2 8-54-43 (32-13-10-9-11-14-32,33-15-19-35(51-7)20-16-33)34-17-21 -36 (52-8)22-18-34/h9-11,13-22,27,29-30,37-39,41H,12,24-26,28H2, 1-8H3,(H,45,48,49)/t37-,38-,39-,41-,58?/m1/s1
InChi Key
YFRRKZDUDXHJNC-KZQAAKLLSA-N
Wasu Sunaye 17 na wannan Abu
Uridine, 5'-O- [bis (4-methoxyphenyl) phenylmethyl]-2′-O(2-methoxyethyl) - 5-methyl-, 3′- [2-cyanoethyl bis (1-methylethyl) phosphore
amidite] (9CI); 10: PN: US20030212017 SHAFI: 18 da'awar RNA; 11: PN: US20030211606 SHAFI: 18 da'awar RNA; 13: PN: US20040
005569 SHAFI: 21 da'awar RNA; 13: PN: US20040006030 SHAFI: 22 da'awar RNA; 13: PN: US20040014048 SHAFI: 19 da'awar RNA; 13: PN: US20040014049 SHAFI: 19 da'awar RNA; 14: PN: US20030198965 SHAFI: 19 da'awar RNA; 14: PN: US20040005565 SHAFI: 17- 22 da'awar RNA; 14: PN: US20040005570 SHAFI: 19 da'awar RNA; 14: PN: US20040014047 SHAFI: 19 da'awar RNA; 14: PN: US20040
014699 SHAFI: 19 da'awar RNA; 15: PN: US20040014050 SHAFI: 19 da'awar RNA; 15: PN: US20040014051 SHAFI: 21 da'awar RNA; 15:
PN: WO03106645 SHAFI: 69 da'awar RNA; 16: PN: US20040006029 SHAFI: 22 da'awar RNA; 87: PN: US20040005707 SHAFI: 19 da'awar RNA
Spectra akwai
1 H NMR
13 C NMR
Farashin NMR
Properties akwai
Halittu
Chemical
Lipinski
Tsarin Yanayi
Dukiya | Daraja | Yanayi | Source |
Factor na Bioconcentration | 348 | pH da 1; Zazzabi: 25 ° C | (1) ACD |
Factor na Bioconcentration | 2810 | pH da 2; Zazzabi: 25 ° C | (1) ACD |
Factor na Bioconcentration | 21100 | pH da 3; Zazzabi: 25 ° C | (1) ACD |
Factor na Bioconcentration | 63100 | pH da 4; Zazzabi: 25 ° C | (1) ACD |
Factor na Bioconcentration | 78800 | pH da 5; Zazzabi: 25 ° C | (1) ACD |
Factor na Bioconcentration | 80800 | pH da 6; Zazzabi: 25 ° C | (1) ACD |
Factor na Bioconcentration | 80800 | pH da 7; Zazzabi: 25 ° C | (1) ACD |
Factor na Bioconcentration | 78800 | pH da 8; Zazzabi: 25 ° C | (1) ACD |
Factor na Bioconcentration | 63400 | pH da 9; Zazzabi: 25 ° C | (1) ACD |
Factor na Bioconcentration | 21800 | 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)
Dukiya | Daraja | Yanayi | Source |
Koc | 487 | pH da 1; Zazzabi: 25 ° C | (1) ACD |
Koc | 3940 | pH da 2; Zazzabi: 25 ° C | (1) ACD |
Koc | 29600 | pH da 3; Zazzabi: 25 ° C | (1) ACD |
Koc | 88400 | pH da 4; Zazzabi: 25 ° C | (1) ACD |
Dukiya | Daraja | Yanayi | Source |
Koc | 1.10 x 105 | pH da 5; Zazzabi: 25 ° C | (1) ACD |
Koc | 1.13 x 105 | pH da 6; Zazzabi: 25 ° C | (1) ACD |
Koc | 1.13 x 105 | pH da 7; Zazzabi: 25 ° C | (1) ACD |
Koc | 1.10 x 105 | pH da 8; Zazzabi: 25 ° C | (1) ACD |
Koc | 88800 | pH da 9; Zazzabi: 25 ° C | (1) ACD |
Koc | 30600 | pH 10; Zazzabi: 25 ° C | (1) ACD |
logD | 4.39 | pH da 1; Zazzabi: 25 ° C | (1) ACD |
logD | 5.30 | pH da 2; Zazzabi: 25 ° C | (1) ACD |
logD | 6.18 | pH da 3; Zazzabi: 25 ° C | (1) ACD |
logD | 6.65 | pH da 4; Zazzabi: 25 ° C | (1) ACD |
logD | 6.75 | pH da 5; Zazzabi: 25 ° C | (1) ACD |
logD | 6.76 | pH da 6; Zazzabi: 25 ° C | (1) ACD |
logD | 6.76 | pH da 7; Zazzabi: 25 ° C | (1) ACD |
logD | 6.75 | pH da 8; Zazzabi: 25 ° C | (1) ACD |
logD | 6.65 | pH da 9; Zazzabi: 25 ° C | (1) ACD |
logD | 6.19 | pH 10; Zazzabi: 25 ° C | (1) ACD |
logP | 6.761± 0.669 | Zazzabi: 25 ° C | (1) ACD |
Mass Intrinsic Solubility | 2.0 x 10-4 g/L | Zazzabi: 25 ° C | (1) ACD |
Mass Solubility | 0.046 g/L | pH da 1; Zazzabi: 25 ° C | (1) ACD |
Mass Solubility | 5.7 x 10-3 g/L | pH da 2; Zazzabi: 25 ° C | (1) ACD |
Mass Solubility | 7.6 x 10-4 g/L | pH da 3; Zazzabi: 25 ° C | (1) ACD |
Mass Solubility | 2.5 x 10-4 g/L | pH da 4; Zazzabi: 25 ° C | (1) ACD |
Mass Solubility | 2.0 x 10-4 g/L | pH da 5; Zazzabi: 25 ° C | (1) ACD |
Mass Solubility | 2.0 x 10-4 g/L | pH da 6; Zazzabi: 25 ° C | (1) ACD |
Mass Solubility | 2.0 x 10-4 g/L | pH da 7; Zazzabi: 25 ° C | (1) ACD |
Mass Solubility | 2.0 x 10-4 g/L | pH da 8; Zazzabi: 25 ° C | (1) ACD |
Mass Solubility | 2.5 x 10-4 g/L | pH da 9; Zazzabi: 25 ° C | (1) ACD |
Mass Solubility | 7.4 x 10-4 g/L | pH 10; Zazzabi: 25 ° C | (1) ACD |
Mass Solubility | 2.0 x 10-4 g/L | Ruwan da ba a buƙata ba pH 7.00; Zazzabi: 25 ° C | (1) ACD |
Solubility na Ciki na Molar | 2.4 x 10-7 mol/L | Zazzabi: 25 ° C | (1) ACD |
Solubility na Molar | 5.6 x 10-5 mol/L | pH da 1; Zazzabi: 25 ° C | (1) ACD |
Solubility na Molar | 7.0 x 10-6 mol/L | pH da 2; Zazzabi: 25 ° C | (1) ACD |
Dukiya | Daraja | Yanayi | Source |
Solubility na Molar | 9.3 x 10-7 mol/L | pH da 3; Zazzabi: 25 ° C | (1) ACD |
Solubility na Molar | 3.1 x 10-7 mol/L | pH da 4; Zazzabi: 25 ° C | (1) ACD |
Solubility na Molar | 2.5 x 10-7 mol/L | pH da 5; Zazzabi: 25 ° C | (1) ACD |
Solubility na Molar | 2.4 x 10-7 mol/L | pH da 6; Zazzabi: 25 ° C | (1) ACD |
Solubility na Molar | 2.4 x 10-7 mol/L | pH da 7; Zazzabi: 25 ° C | (1) ACD |
Solubility na Molar | 2.5 x 10-7 mol/L | pH da 8; Zazzabi: 25 ° C | (1) ACD |
Solubility na Molar | 3.1 x 10-7 mol/L | pH da 9; Zazzabi: 25 ° C | (1) ACD |
Solubility na Molar | 9.0 x 10-7 mol/L | pH 10; Zazzabi: 25 ° C | (1) ACD |
Solubility na Molar | 2.4 x 10-7 mol/L | Ruwan da ba a buƙata ba pH 7.00; Zazzabi: 25 ° C | (1) ACD |
Nauyin Kwayoyin Halitta | 818.89 | ||
pKa | 9.55± 0.10 | Mafi yawan zafin jiki: 25 ° C | (1) ACD |
pKa | 3.45± 0.70 | 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 | Yanayi | Source |
Ƙimar Rarraba Kyauta | 21 | (1) ACD | |
H Masu karɓa | 14 | (1) ACD | |
H Masu Ba da taimako | 1 | (1) ACD | |
H Donor/Acceptor Sum | 15 | (1) ACD | |
logP | 6.761± 0.669 | Zazzabi: 25 ° C | (1) ACD |
Nauyin Kwayoyin Halitta | 818.89 |
(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 | 164 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
1 H NMR
13 C NMR
Tushen Bayanin Hazard na Code | |
H302 Yana da illa idan an haɗiye shi | Rarraba Hukumar Kula da Sinadarai ta Turai (ECHA) & Lakabi Inventory - Sanarwa Rarrabawa da lakabi - sanarwar da aka fi sani, Hukumar Kula da Sinadarai ta Turai (ECHA) Rabewa&Kyakkyawan Lakabi - Faɗakarwar Rarrabawa da Lakabi - sanarwa mafi mahimmanci |