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)
Nambari ya Usajili ya CAS
163878-63-5
H302
Sifa Muhimu za Kimwili | Thamani | Hali |
Uzito wa Masi | 818.89 | - |
pKa (Iliyotabiriwa) | 9.55±0.10 | Halijoto ya Asidi Zaidi: 25 °C |
TABASAMU za Kikanuni
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
Isomeric TABASAMU
C(OC[C@@H]1[C@@H](OP(N(C(C)C)C(C)C)OCCC#N)[C@@H](OCCOC)[C@@ 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
Ufunguo wa InChI
YFRRKZDUDXHJNC-KZQAAKLLSA-N
17 Majina Mengine ya Dawa hii
Uridine, 5′-O- [bis(4-methoxyphenyl)phenylmethyl]-2′ -O-(2-methoxyethyl)- 5-methyl-, 3′ - [2-cyanoethyl bis(1-methylethyl)phosphor
amidite] (9CI); 10: PN: US20030212017 UKURASA: 18 walidai RNA; 11: PN: US20030211606 UKURASA: 18 walidai RNA; 13: PN: US20040
005569 UKURASA: 21 walidai RNA; 13: PN: US20040006030 UKURASA: 22 walidai RNA; 13: PN: US20040014048 UKURASA: 19 walidai RNA; 13: PN: US20040014049 UKURASA: 19 walidai RNA; 14: PN: US20030198965 UKURASA: 19 walidai RNA; 14: PN: US20040005565 UKURASA: 17- 22 alidai RNA; 14: PN: US20040005570 UKURASA: 19 walidai RNA; 14: PN: US20040014047 UKURASA: 19 walidai RNA; 14: PN: US20040
014699 UKURASA: 19 walidai RNA; 15: PN: US20040014050 UKURASA: 19 walidai RNA; 15: PN: US20040014051 UKURASA: 21 walidai RNA; 15:
PN: WO03106645 UKURASA: 69 walidai RNA; 16: PN: US20040006029 UKURASA: 22 walidai RNA; 87: PN: US20040005707 UKURASA: 19 walidai RNA
Spectra inapatikana
1 H NMR
13 C NMR
Hetero NMR
Mali zinazopatikana
Kibiolojia
Kemikali
Lipinski
Kuhusiana na Muundo
Mali | Thamani | Hali | Chanzo |
Kipengele cha Mkusanyiko wa Kibiolojia | 348 | pH 1; Joto: 25 °C | (1) ACD |
Kipengele cha Mkusanyiko wa Kibiolojia | 2810 | pH 2; Joto: 25 °C | (1) ACD |
Kipengele cha Mkusanyiko wa Kibiolojia | 21100 | pH 3; Joto: 25 °C | (1) ACD |
Kipengele cha Mkusanyiko wa Kibiolojia | 63100 | pH 4; Joto: 25 °C | (1) ACD |
Kipengele cha Mkusanyiko wa Kibiolojia | 78800 | pH 5; Joto: 25 °C | (1) ACD |
Kipengele cha Mkusanyiko wa Kibiolojia | 80800 | pH 6; Joto: 25 °C | (1) ACD |
Kipengele cha Mkusanyiko wa Kibiolojia | 80800 | pH 7; Joto: 25 °C | (1) ACD |
Kipengele cha Mkusanyiko wa Kibiolojia | 78800 | pH 8; Joto: 25 °C | (1) ACD |
Kipengele cha Mkusanyiko wa Kibiolojia | 63400 | pH 9; Joto: 25 °C | (1) ACD |
Kipengele cha Mkusanyiko wa Kibiolojia | 21800 | pH 10; Joto: 25 °C | (1) ACD |
(1) Imekokotolewa kwa kutumia Advanced Kemia Development (ACD/Labs) Programu V11.02 (© 1994-2023 ACD/Labs)
Mali | Thamani | Hali | Chanzo |
Koc | 487 | pH 1; Joto: 25 °C | (1) ACD |
Koc | 3940 | pH 2; Joto: 25 °C | (1) ACD |
Koc | 29600 | pH 3; Joto: 25 °C | (1) ACD |
Koc | 88400 | pH 4; Joto: 25 °C | (1) ACD |
Mali | Thamani | Hali | Chanzo |
Koc | 1.10 x 105 | pH 5; Joto: 25 °C | (1) ACD |
Koc | 1.13 x 105 | pH 6; Joto: 25 °C | (1) ACD |
Koc | 1.13 x 105 | pH 7; Joto: 25 °C | (1) ACD |
Koc | 1.10 x 105 | pH 8; Joto: 25 °C | (1) ACD |
Koc | 88800 | pH 9; Joto: 25 °C | (1) ACD |
Koc | 30600 | pH 10; Joto: 25 °C | (1) ACD |
logD | 4.39 | pH 1; Joto: 25 °C | (1) ACD |
logD | 5.30 | pH 2; Joto: 25 °C | (1) ACD |
logD | 6.18 | pH 3; Joto: 25 °C | (1) ACD |
logD | 6.65 | pH 4; Joto: 25 °C | (1) ACD |
logD | 6.75 | pH 5; Joto: 25 °C | (1) ACD |
logD | 6.76 | pH 6; Joto: 25 °C | (1) ACD |
logD | 6.76 | pH 7; Joto: 25 °C | (1) ACD |
logD | 6.75 | pH 8; Joto: 25 °C | (1) ACD |
logD | 6.65 | pH 9; Joto: 25 °C | (1) ACD |
logD | 6.19 | pH 10; Joto: 25 °C | (1) ACD |
logP | 6.761±0.669 | Joto: 25 °C | (1) ACD |
Umumunyifu wa Ndani wa Misa | 2.0 x 10-4 g/L | Joto: 25 °C | (1) ACD |
Umumunyifu wa Misa | 0.046 g/L | pH 1; Joto: 25 °C | (1) ACD |
Umumunyifu wa Misa | 5.7 x 10-3 g/L | pH 2; Joto: 25 °C | (1) ACD |
Umumunyifu wa Misa | 7.6 x 10-4 g/L | pH 3; Joto: 25 °C | (1) ACD |
Umumunyifu wa Misa | 2.5 x 10-4 g/L | pH 4; Joto: 25 °C | (1) ACD |
Umumunyifu wa Misa | 2.0 x 10-4 g/L | pH 5; Joto: 25 °C | (1) ACD |
Umumunyifu wa Misa | 2.0 x 10-4 g/L | pH 6; Joto: 25 °C | (1) ACD |
Umumunyifu wa Misa | 2.0 x 10-4 g/L | pH 7; Joto: 25 °C | (1) ACD |
Umumunyifu wa Misa | 2.0 x 10-4 g/L | pH 8; Joto: 25 °C | (1) ACD |
Umumunyifu wa Misa | 2.5 x 10-4 g/L | pH 9; Joto: 25 °C | (1) ACD |
Umumunyifu wa Misa | 7.4 x 10-4 g/L | pH 10; Joto: 25 °C | (1) ACD |
Umumunyifu wa Misa | 2.0 x 10-4 g/L | Maji yasiyo na buffered pH 7.00; Joto: 25 °C | (1) ACD |
Umumunyifu wa Ndani wa Molar | 2.4 x 10-7 mol/L | Joto: 25 °C | (1) ACD |
Umumunyifu wa Molar | 5.6 x 10-5 mol/L | pH 1; Joto: 25 °C | (1) ACD |
Umumunyifu wa Molar | 7.0 x 10-6 mol/L | pH 2; Joto: 25 °C | (1) ACD |
Mali | Thamani | Hali | Chanzo |
Umumunyifu wa Molar | 9.3 x 10-7 mol/L | pH 3; Joto: 25 °C | (1) ACD |
Umumunyifu wa Molar | 3.1 x 10-7 mol/L | pH 4; Joto: 25 °C | (1) ACD |
Umumunyifu wa Molar | 2.5 x 10-7 mol/L | pH 5; Joto: 25 °C | (1) ACD |
Umumunyifu wa Molar | 2.4 x 10-7 mol/L | pH 6; Joto: 25 °C | (1) ACD |
Umumunyifu wa Molar | 2.4 x 10-7 mol/L | pH 7; Joto: 25 °C | (1) ACD |
Umumunyifu wa Molar | 2.5 x 10-7 mol/L | pH 8; Joto: 25 °C | (1) ACD |
Umumunyifu wa Molar | 3.1 x 10-7 mol/L | pH 9; Joto: 25 °C | (1) ACD |
Umumunyifu wa Molar | 9.0 x 10-7 mol/L | pH 10; Joto: 25 °C | (1) ACD |
Umumunyifu wa Molar | 2.4 x 10-7 mol/L | Maji yasiyo na buffered pH 7.00; Joto: 25 °C | (1) ACD |
Uzito wa Masi | 818.89 | ||
pKa | 9.55±0.10 | Halijoto ya Asidi Zaidi: 25 °C | (1) ACD |
pKa | 3.45±0.70 | Joto la Msingi Zaidi: 25 °C | (1) ACD |
(1) Imekokotolewa kwa kutumia Advanced Kemia Development (ACD/Labs) Programu V11.02 (© 1994-2023 ACD/Labs)
Mali | Thamani | Hali | Chanzo |
Vifungo vinavyoweza kuzungushwa kwa Uhuru | 21 | (1) ACD | |
H Wapokeaji | 14 | (1) ACD | |
H Wafadhili | 1 | (1) ACD | |
H Jumla ya Mfadhili/Mpokeaji | 15 | (1) ACD | |
logP | 6.761±0.669 | Joto: 25 °C | (1) ACD |
Uzito wa Masi | 818.89 |
(1) Imekokotolewa kwa kutumia Advanced Kemia Development (ACD/Labs) Programu V11.02 (© 1994-2023 ACD/Labs)
Mali | Thamani | Chanzo cha Hali |
Eneo la Uso wa Polar | 164 A2 | (1) ACD |
(1) Imekokotolewa kwa kutumia Advanced Kemia Development (ACD/Labs) Programu V11.02 (© 1994-2023 ACD/Labs)
Spectra inapatikana
1 H NMR
13 C NMR
Chanzo cha Taarifa ya Hatari ya Kanuni | |
H302 Inadhuru ikiwa imemeza | Uainishaji na Uwekaji Lebo kwa Wakala wa Kemikali wa Ulaya (ECHA). Malipo - Uainishaji ulioarifiwa na uwekaji lebo - arifa za kawaida zaidi, Wakala wa Kemikali wa Ulaya (ECHA) Uainishaji&Uwekaji Lebo - Uainishaji ulioarifiwa na uwekaji lebo - arifa muhimu zaidi |