C41H49FN5O8P cytidine, N-acetyl-5 ′ -O- [bis (4-methoxyphenyl) phenylmethyl] -2 ′-deoxy-2 ′ -fluoro-, 3 ′-[2-cyanoethyl N, N-bis (1-methylethyl) phosphor (2-cyanoethyl N, N-BIS (1-methylethyl) phosphor (2-cyanoethyl N, N-BIS (1-methylethyl) phosphor (2-cyanoethyl N, N-BIS (1-methylethyl) phosphor (2-cyanoethyl N, N-BIS (1-methylethyl) phosphor (2-cyanoethyl N, N-BIS (1-methylethyl)
Nambari ya Usajili wa CAS
159414-99-0
Sifa muhimu za mwili | Thamani | Hali |
Uzito wa Masi | 789.83 | - |
PKA (alitabiri) | 10.11 ± 0.20 | Templeti nyingi za asidi: 25 ° C. |
Tabasamu za Canonical
N#CCCOP (OC1C (F) C (OC1COC (C = 2C = CC = CC2) (C3 = CC = C (OC) C = C3) C4 = CC = C (OC) C = C4) N5C = CC (= NC5 = O) NC (= O) C) N (C (C) C (C (C) C (C (C) C (C (C) C (C (C) C (C (C) C (C) C (C) C (C) C (C) C (C) C (C) C (C) C (C) C (C) C (C) C (C) C (C) C (C) C (C) C (C) C (C) C (C) C (C) C (C) C (C) 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] (F) [C @@ H] (O1) N2C (= O) N = C (NC (C) = O) C = C2) (C3 = CC = C (C) (C3) (C) (C3) (C3) (C3) (C3) (C) (C) (OC) C = C4) C5 = CC = CC = C5
Inchi
Inchi = 1S/C41H49FN5O8P/C1-27 (2) 47 (28 (3) 4) 56 (53-25-11-23-43) 55-38-35 (54-39 (37 (38) 42) 46-24-22-36 (44-29) (44-29 (44-49 (44-49 (449) (44-49 (449 48 (449) (449 48 (449 48 (449) 41 (30-12-9-8-10-13-30,31-14-18-33 (50-6) 19-15-31) 32-16-20-34 (51-7) 21-17-32/H8-10,12-22,24,27-28,35,37-39h, 11,25-22,2,12,25-25-25-25-25-25-25-25-25-25-25-26-25-26-25-26-26-25-26-25-25-26-26-26-26-26-26-25 44,45,48,49)/T35-, 37-, 38-, 39-, 56?/M1/S1
Ufunguo wa Inchi
Cnfkjhkdsrxnfl-utxremqhsa-n
1 Jina lingine kwa dutu hii
Cytidine,N-acetyl -5 ′ -O-[bis (4-methoxyphenyl) phenylmethyl] -2 ′ -deoxy-2 ′ -fluoro-, 3 ′-[2-cyanoethyl bis (1-methylethyl) phosphor amidite] (9ci)
Spectra inapatikana
Misa
Mali inapatikana
Kibaolojia
Kemikali
Lipinski
Muundo unaohusiana
Mali | Thamani | Hali | Chanzo |
Sababu ya bioconcentration | 8.60 | pH 1; Temp: 25 ° c | (1) ACD |
Sababu ya bioconcentration | 90.3 | pH 2; Temp: 25 ° c | (1) ACD |
Sababu ya bioconcentration | 3940 | pH 3; Temp: 25 ° c | (1) ACD |
Sababu ya bioconcentration | 39100 | pH 4; Temp: 25 ° c | (1) ACD |
Sababu ya bioconcentration | 64300 | pH 5; Temp: 25 ° c | (1) ACD |
Sababu ya bioconcentration | 68100 | pH 6; Temp: 25 ° c | (1) ACD |
Sababu ya bioconcentration | 68300 | pH 7; Temp: 25 ° c | (1) ACD |
Sababu ya bioconcentration | 66800 | pH 8; Temp: 25 ° c | (1) ACD |
Sababu ya bioconcentration | 54300 | pH 9; Temp: 25 ° c | (1) ACD |
Sababu ya bioconcentration | 19200 | pH 10; Temp: 25 ° c | (1) ACD |
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Mali | Thamani | Hali | Chanzo |
KOC | 12.6 | pH 1; Temp: 25 ° c | (1) ACD |
KOC | 133 | pH 2; Temp: 25 ° c | (1) ACD |
KOC | 5790 | pH 3; Temp: 25 ° c | (1) ACD |
KOC | 57400 | pH 4; Temp: 25 ° c | (1) ACD |
KOC | 94500 | pH 5; Temp: 25 ° c | (1) ACD |
KOC | 1.00 x 105 | pH 6; Temp: 25 ° c | (1) ACD |
KOC | 1.00 x 105 | pH 7; Temp: 25 ° c | (1) ACD |
KOC | 98200 | pH 8; Temp: 25 ° c | (1) ACD |
KOC | 79700 | pH 9; Temp: 25 ° c | (1) ACD |
KOC | 28200 | pH 10; Temp: 25 ° c | (1) ACD |
Mali | Thamani | Hali | Chanzo |
logi | 2.76 | pH 1; Temp: 25 ° c | (1) ACD |
logi | 3.79 | pH 2; Temp: 25 ° c | (1) ACD |
logi | 5.43 | pH 3; Temp: 25 ° c | (1) ACD |
logi | 6.42 | pH 4; Temp: 25 ° c | (1) ACD |
logi | 6.64 | pH 5; Temp: 25 ° c | (1) ACD |
logi | 6.66 | pH 6; Temp: 25 ° c | (1) ACD |
logi | 6.66 | pH 7; Temp: 25 ° c | (1) ACD |
logi | 6.65 | pH 8; Temp: 25 ° c | (1) ACD |
logi | 6.56 | pH 9; Temp: 25 ° c | (1) ACD |
logi | 6.11 | pH 10; Temp: 25 ° c | (1) ACD |
Logp | 6.666 ± 0.764 | Temp: 25 ° c | (1) ACD |
Umumunyifu wa ndani | 4.5 x 10-5 g/l | Temp: 25 ° c | (1) ACD |
Umumunyifu wa wingi | 0.36 g/l | pH 1; Temp: 25 ° c | (1) ACD |
Umumunyifu wa wingi | 0.035 g/l | pH 2; Temp: 25 ° c | (1) ACD |
Umumunyifu wa wingi | 7.90 x 10-4 g/l | pH 3; Temp: 25 ° c | (1) ACD |
Umumunyifu wa wingi | 7.9 x 10-5 g/l | pH 4; Temp: 25 ° c | (1) ACD |
Umumunyifu wa wingi | 4.8 x 10-5 g/l | pH 5; Temp: 25 ° c | (1) ACD |
Umumunyifu wa wingi | 4.6 x 10-5 g/l | pH 6; Temp: 25 ° c | (1) ACD |
Umumunyifu wa wingi | 4.6 x 10-5 g/l | pH 7; Temp: 25 ° c | (1) ACD |
Umumunyifu wa wingi | 4.7 x 10-5 g/l | pH 8; Temp: 25 ° c | (1) ACD |
Umumunyifu wa wingi | 5.7 x 10-5 g/l | pH 9; Temp: 25 ° c | (1) ACD |
Umumunyifu wa wingi | 1.6 x 10-4 g/l | pH 10; Temp: 25 ° c | (1) ACD |
Umumunyifu wa wingi | 4.6 x 10-5 g/l | Maji yasiyokuwa na maji pH 7.00; Temp: 25 ° c | (1) ACD |
Umumunyifu wa ndani wa molar | 5.7 x 10-8 mol/l | Temp: 25 ° c | (1) ACD |
Umumunyifu wa molar | 4.6 x 10-4 mol/l | pH 1; Temp: 25 ° c | (1) ACD |
Umumunyifu wa molar | 4.4 x 10-5 mol/l | pH 2; Temp: 25 ° c | (1) ACD |
Umumunyifu wa molar | 1.00 x 10-6 mol/l | pH 3; Temp: 25 ° c | (1) ACD |
Umumunyifu wa molar | 1.0 x 10-7 mol/l | pH 4; Temp: 25 ° c | (1) ACD |
Umumunyifu wa molar | 6.1 x 10-8 mol/l | pH 5; Temp: 25 ° c | (1) ACD |
Umumunyifu wa molar | 5.8 x 10-8 mol/l | pH 6; Temp: 25 ° c | (1) ACD |
Umumunyifu wa molar | 5.8 x 10-8 mol/l | pH 7; Temp: 25 ° c | (1) ACD |
Umumunyifu wa molar | 5.9 x 10-8 mol/l | pH 8; Temp: 25 ° c | (1) ACD |
Mali | Thamani | Hali | Chanzo |
Umumunyifu wa molar | 7.2 x 10-8 mol/l | pH 9; Temp: 25 ° c | (1) ACD |
Umumunyifu wa molar | 2.0 x 10-7 mol/l | pH 10; Temp: 25 ° c | (1) ACD |
Umumunyifu wa molar | 5.8 x 10-8 mol/l | Maji yasiyokuwa na maji pH 7.00; Temp: 25 ° c | (1) ACD |
Uzito wa Masi | 789.83 | ||
PKA | 10.11 ± 0.20 | Templeti nyingi za asidi: 25 ° C. | (1) ACD |
PKA | 3.57 ± 0.20 | Muda wa msingi zaidi: 25 ° C. | (1) ACD |
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Mali | Thamani | Chanzo cha hali |
Eneo la uso wa polar | 158 A2 | (1) ACD |
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