![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) phosphoramididite] (acided picha)](https://cdn.globalso.com/nvchem/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)
Nambari ya Usajili wa CAS
199593-09-4
| Sifa muhimu za mwili | Thamani | Hali |
| Uzito wa Masi | 801.87 | - |
| PKA (alitabiri) | 10.18 ± 0.20 | Templeti nyingi za asidi: 25 ° C. |
Tabasamu za 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
Tabasamu za Isomeric
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 (C = C3) (C3) (C3) (C) (C3) (C) (C) (C3) (C) (C) (C) (C) (C) (C) (C) (C) (C) = 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 (44-30 (44-30 (44-30 (44-44) (444-44-30 (444-48 (444-48 (59 48 (448 (44 48 (448 (448 (444-44) (444-30 (444-30 (444-44) ( -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
Ufunguo wa Inchi
Wnwumipfloktez-uaqipllrsa-n
1 Jina lingine kwa dutu hii
Cytidine,N-acetyl -5 ′ -O-[bis (4-methoxyphenyl) phenylmethyl] -2 ′--O-Methyl-, 3 ′-[2-cyanoethyl bis (1-methylethyl) phosphoramidite] (9ci)
Mali inapatikana
Kibaolojia
Kemikali
Lipinski
Muundo unaohusiana
| Mali | Thamani | Hali | Chanzo |
| Sababu ya bioconcentration | 4.77 | pH 1; Temp: 25 ° c | (1) ACD |
| Sababu ya bioconcentration | 50.1 | pH 2; Temp: 25 ° c | (1) ACD |
| Sababu ya bioconcentration | 2190 | pH 3; Temp: 25 ° c | (1) ACD |
| Sababu ya bioconcentration | 21700 | pH 4; Temp: 25 ° c | (1) ACD |
| Sababu ya bioconcentration | 35700 | pH 5; Temp: 25 ° c | (1) ACD |
| Sababu ya bioconcentration | 37800 | pH 6; Temp: 25 ° c | (1) ACD |
| Sababu ya bioconcentration | 37900 | pH 7; Temp: 25 ° c | (1) ACD |
| Sababu ya bioconcentration | 37300 | pH 8; Temp: 25 ° c | (1) ACD |
| Sababu ya bioconcentration | 31400 | pH 9; Temp: 25 ° c | (1) ACD |
| Sababu ya bioconcentration | 12300 | pH 10; Temp: 25 ° c | (1) ACD |
.
| Chanzo cha hali ya thamani ya mali |
| KOC 8.29 pH 1; Temp: 25 ° C (1) ACD |
| KOC 87.1 pH 2; Temp: 25 ° C (1) ACD |
| KOC 3800 pH 3; Temp: 25 ° C (1) ACD |
| KOC 37700 pH 4; Temp: 25 ° C (1) ACD |
| KOC 62000 pH 5; Temp: 25 ° C (1) ACD |
| KOC 65700 pH 6; Temp: 25 ° C (1) ACD |
| KOC 65900 pH 7; Temp: 25 ° C (1) ACD |
| KOC 64700 pH 8; Temp: 25 ° C (1) ACD |
| KOC 54500 pH 9; Temp: 25 ° C (1) ACD |
| KOC 21400 pH 10; Temp: 25 ° C (1) ACD |
| logi 2.43 pH 1; Temp: 25 ° C (1) ACD |
| logi 3.45 pH 2; Temp: 25 ° C (1) ACD |
| logd 5.09 pH 3; Temp: 25 ° C (1) ACD |
| Mali | Thamani | Hali | Chanzo |
| logi | 6.09 | pH 4; Temp: 25 ° c | (1) ACD |
| logi | 6.30 | pH 5; Temp: 25 ° c | (1) ACD |
| logi | 6.33 | pH 6; Temp: 25 ° c | (1) ACD |
| logi | 6.33 | pH 7; Temp: 25 ° c | (1) ACD |
| logi | 6.32 | pH 8; Temp: 25 ° c | (1) ACD |
| logi | 6.25 | pH 9; Temp: 25 ° c | (1) ACD |
| logi | 5.84 | pH 10; Temp: 25 ° c | (1) ACD |
| Logp | 6.329 ± 0.771 | Temp: 25 ° c | (1) ACD |
| Umumunyifu wa ndani | 1.8 x 10-4 g/l | Temp: 25 ° c | (1) ACD |
| Umumunyifu wa wingi | 1.4 g/l | pH 1; Temp: 25 ° c | (1) ACD |
| Umumunyifu wa wingi | 0.14 g/l | pH 2; Temp: 25 ° c | (1) ACD |
| Umumunyifu wa wingi | 3.1 x 10-3 g/l | pH 3; Temp: 25 ° c | (1) ACD |
| Umumunyifu wa wingi | 3.2 x 10-4 g/l | pH 4; Temp: 25 ° c | (1) ACD |
| Umumunyifu wa wingi | 1.9 x 10-4 g/l | pH 5; Temp: 25 ° c | (1) ACD |
| Umumunyifu wa wingi | 1.8 x 10-4 g/l | pH 6; Temp: 25 ° c | (1) ACD |
| Umumunyifu wa wingi | 1.8 x 10-4 g/l | pH 7; Temp: 25 ° c | (1) ACD |
| Umumunyifu wa wingi | 1.8 x 10-4 g/l | pH 8; Temp: 25 ° c | (1) ACD |
| Umumunyifu wa wingi | 2.2 x 10-4 g/l | pH 9; Temp: 25 ° c | (1) ACD |
| Umumunyifu wa wingi | 5.6 x 10-4 g/l | pH 10; Temp: 25 ° c | (1) ACD |
| Umumunyifu wa wingi | 1.8 x 10-4 g/l | Maji yasiyokuwa na maji pH 7.00; Temp: 25 ° c | (1) ACD |
| Umumunyifu wa ndani wa molar | 2.3 x 10-7 mol/l | Temp: 25 ° c | (1) ACD |
| Umumunyifu wa molar | 1.8 x 10-3 mol/l | pH 1; Temp: 25 ° c | (1) ACD |
| Umumunyifu wa molar | 1.7 x 10-4 mol/l | pH 2; Temp: 25 ° c | (1) ACD |
| Umumunyifu wa molar | 3.9 x 10-6 mol/l | pH 3; Temp: 25 ° c | (1) ACD |
| Umumunyifu wa molar | 4.0 x 10-7 mol/l | pH 4; Temp: 25 ° c | (1) ACD |
| Umumunyifu wa molar | 2.4 x 10-7 mol/l | pH 5; Temp: 25 ° c | (1) ACD |
| Umumunyifu wa molar | 2.3 x 10-7 mol/l | pH 6; Temp: 25 ° c | (1) ACD |
| Umumunyifu wa molar | 2.3 x 10-7 mol/l | pH 7; Temp: 25 ° c | (1) ACD |
| Umumunyifu wa molar | 2.3 x 10-7 mol/l | pH 8; Temp: 25 ° c | (1) ACD |
| Umumunyifu wa molar | 2.8 x 10-7 mol/l | pH 9; Temp: 25 ° c | (1) ACD |
| Umumunyifu wa molar | 7.0 x 10-7 mol/l | pH 10; Temp: 25 ° c | (1) ACD |
| Umumunyifu wa molar | 2.3 x 10-7 mol/l | Maji yasiyokuwa na maji pH 7.00; Temp: 25 ° c | (1) ACD |
| Mali | Thamani | Hali | Chanzo |
| Uzito wa Masi | 801.87 | ||
| PKA | 10.18 ± 0.20 | Templeti nyingi za asidi: 25 ° C. | (1) ACD |
| PKA | 3.57 ± 0.20 | Muda wa msingi zaidi: 25 ° C. | (1) ACD |
.
| Mali | Thamani | Hali | Chanzo |
| Vifungo vya mzunguko wa bure | 18 | (1) ACD | |
| Wapokeaji | 14 | (1) ACD | |
| H wafadhili | 1 | (1) ACD | |
| H wafadhili/jumla ya jumla | 15 | (1) ACD | |
| Logp | 6.329 ± 0.771 | Temp: 25 ° c | (1) ACD |
| Uzito wa Masi | 801.87 |
.
| Mali | Thamani | Chanzo cha hali |
| Eneo la uso wa polar | 167 A2 | (1) ACD |
.
Spectra inapatikana
1H NMR
13C NMR
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![C44H49N5O7si adenosine, n-benzoyl-5'-o- [bis (4-methoxyphenyl) phenylmethyl] -2'- O-[(1,1-dimethylethyl) dimethylsilyl]-(9ci, ACI)](https://cdn.globalso.com/nvchem/C44H49N5O7Si-Adenosine-300x300.jpg)
