C21h21n3o6 thymidine, α - ((1-Naphthalenylmethyl) Amino] - α -ONOO- (aside)
Umubare wa kabiri
1262015-90-6
Imbaraga z'umubiri | Agaciro | Imiterere |
Uburemere bwa molekile | 411.41 | - |
Ubucucike (bwahanuwe) | 1.460 ± 0.06 g / cm3 | Temp: 20 ° C; Kanda: 760 Torr |
PKA (byahanuwe) | 8.23 ± 0.10 | Acide menshi: 25 ° C. |
Inseko ya kanonical
O = c1nc (= o) n (c1c (= o) NCC2 = CC = 3c = 3c = CC32) C (o) C. O) C4
Isomenic kumwenyura
O = c1n (c = c (c (cct = 2c3 = CC2) C. CC) = CC = CC) (CO) (CO) (CO) (o) c4
Inchi
Inchi = 1s / c21h21n3o6 / c25-11-17-16-16-16 (26-18 (30) 2-10 (20) 29-5-1--7-14 (12) 13 / h1- 7,10,16-18,25-26h, 8-9,11h2, (h, 22,27) (h, 23,28,28) / t16- / m0 / s1
Inchi
Uudhoszawihgtb-rccfbdprsa-n
Andi mazina kuriyi ngingo
α - ((1-Naphthalenylmethyl) Amino] - α -Ibisobanuro (ACI); (NaPe); 87: Pn: Won20081510 Seqid: 87 yasabye ko
Ibyiza birahari
Ibinyabuzima
Imiti
Ubucucike
Lipinski
Imiterere
Umutungo | Agaciro | Imiterere | Isoko |
BioConcentration | 3.23 | ph 1; Temp: 25 ° C. | (1) acd |
BioConcentration | 3.23 | ph 2; Temp: 25 ° C. | (1) acd |
BioConcentration | 3.23 | ph 3; Temp: 25 ° C. | (1) acd |
BioConcentration | 3.23 | ph 4; Temp: 25 ° C. | (1) acd |
BioConcentration | 3.23 | ph 5; Temp: 25 ° C. | (1) acd |
BioConcentration | 3.19 | pH 6; Temp: 25 ° C. | (1) acd |
BioConcentration | 2.85 | pH 7; Temp: 25 ° C. | (1) acd |
BioConcentration | 1.40 | ph 8; Temp: 25 ° C. | (1) acd |
BioConcentration | 1.0 | pH 9; Temp: 25 ° C. | (1) acd |
BioConcentration | 1.0 | PH 10; Temp: 25 ° C. | (1) acd |
(1) kubarwa ukoresheje iterambere rya chimie ihamye (acd / laboratwari) software v11.02 (© 1994-2023 acd
Inkomoko yumutungo |
Koc 80.5 PH 1; Temp: 25 ° C (1) acd |
Koc 80.5 PH 2; Temp: 25 ° C (1) acd |
Koc 80.5 PH 3; Temp: 25 ° C (1) acd |
Koc 80.5 PH 4; Temp: 25 ° C (1) acd |
Koc 80.4 ph 5; Temp: 25 ° C (1) acd |
Koc 79.5 PH 6; Temp: 25 ° C (1) acd |
Koc 71.1 PH 7; Temp: 25 ° C (1) acd |
Koc 34.9 PH 8; Temp: 25 ° C (1) acd |
Koc 6.35 PH 9; Temp: 25 ° C (1) acd |
Koc 1.39 ph 10; Temp: 25 ° C (1) acd |
Injira 0.97 PH 1; Temp: 25 ° C (1) acd |
Injira 0.97 PH 2; Temp: 25 ° C (1) acd |
Umutungo | Agaciro | Imiterere | Isoko |
Logd | 0.97 | ph 3; Temp: 25 ° C. | (1) acd |
Logd | 0.97 | ph 4; Temp: 25 ° C. | (1) acd |
Logd | 0.97 | ph 5; Temp: 25 ° C. | (1) acd |
Logd | 0.97 | pH 6; Temp: 25 ° C. | (1) acd |
Logd | 0.92 | pH 7; Temp: 25 ° C. | (1) acd |
Logd | 0.61 | ph 8; Temp: 25 ° C. | (1) acd |
Logd | -0.13 | pH 9; Temp: 25 ° C. | (1) acd |
Logd | -0.79 | PH 10; Temp: 25 ° C. | (1) acd |
LogP | 0.973 ± 0.586 | Temp: 25 ° C. | (1) acd |
Misa yimbere | 5.3 x 10-3 G / L. | Temp: 25 ° C. | (1) acd |
Rusange | 5.3 x 10-3 G / L. | ph 1; Temp: 25 ° C. | (1) acd |
Rusange | 5.3 x 10-3 G / L. | ph 2; Temp: 25 ° C. | (1) acd |
Rusange | 5.3 x 10-3 G / L. | ph 3; Temp: 25 ° C. | (1) acd |
Rusange | 5.3 x 10-3 G / L. | ph 4; Temp: 25 ° C. | (1) acd |
Rusange | 5.3 x 10-3 G / L. | ph 5; Temp: 25 ° C. | (1) acd |
Rusange | 5.3 x 10-3 G / L. | pH 6; Temp: 25 ° C. | (1) acd |
Rusange | 5.8 x 10-3 G / L. | pH 7; Temp: 25 ° C. | (1) acd |
Rusange | 0.012 g / l | ph 8; Temp: 25 ° C. | (1) acd |
Rusange | 0.066 G / L. | pH 9; Temp: 25 ° C. | (1) acd |
Rusange | 0.30 g / l | PH 10; Temp: 25 ° C. | (1) acd |
Rusange | 5.3 x 10-3 G / L. | Itanu y'amazi ya ph 6.37; Temp: 25 ° C. | (1) acd |
Morlar Mainsic Lowelity | 1.3 x 10-5 Mol / l | Temp: 25 ° C. | (1) acd |
Umuryango wawe | 1.3 x 10-5 Mol / l | ph 1; Temp: 25 ° C. | (1) acd |
Umuryango wawe | 1.3 x 10-5 Mol / l | ph 2; Temp: 25 ° C. | (1) acd |
Umuryango wawe | 1.3 x 10-5 Mol / l | ph 3; Temp: 25 ° C. | (1) acd |
Umuryango wawe | 1.3 x 10-5 Mol / l | ph 4; Temp: 25 ° C. | (1) acd |
Umuryango wawe | 1.3 x 10-5 Mol / l | ph 5; Temp: 25 ° C. | (1) acd |
Umuryango wawe | 1.3 x 10-5 Mol / l | pH 6; Temp: 25 ° C. | (1) acd |
Umuryango wawe | 1.4 x 10-5 Mol / l | pH 7; Temp: 25 ° C. | (1) acd |
Umuryango wawe | 2.9 x 10-5 Mol / l | ph 8; Temp: 25 ° C. | (1) acd |
Umuryango wawe | 1.6 x 10-4 Mol / l | pH 9; Temp: 25 ° C. | (1) acd |
Umuryango wawe | 7.4 x 10-4 mol / l | PH 10; Temp: 25 ° C. | (1) acd |
Umutungo | Agaciro | Imiterere | Isoko |
Umuryango wawe | 1.3 x 10-5 Mol / l | Itanu y'amazi ya ph 6.37; Temp: 25 ° C. | (1) acd |
Uburemere bwa molekile | 411.41 | ||
PKA | 8.23 ± 0.10 | Acide menshi: 25 ° C. | (1) acd |
PKA | -1.90 ± 0.20 | Icyiciro cyibanze: 25 ° C. | (1) acd |
(1) kubarwa ukoresheje iterambere rya chimie ihamye (acd / laboratwari) software v11.02 (© 1994-2023 acd
Umutungo | Agaciro | Imiterere | Isoko |
Ubucucike | 1.460 ± 0.06 g / cm3 | Temp: 20 ° C; Kanda: 760 Torr | (1) acd |
Umubumbe | 281.6 ± 3.0 cm3 / mol | Temp: 20 ° C; Kanda: 760 Torr | (1) acd |
(1) kubarwa ukoresheje iterambere rya chimie ihamye (acd / laboratwari) software v11.02 (© 1994-2023 acd
Umutungo | Agaciro | Imiterere | Isoko |
Ubusambanyi bwuzuye | 7 | (1) acd | |
H yemera | 9 | (1) acd | |
H | 4 | (1) acd | |
H umuterankunga / kubyemera | 13 | (1) acd | |
LogP | 0.973 ± 0.586 | Temp: 25 ° C. | (1) acd |
Uburemere bwa molekile | 411.41 |
(1) kubarwa ukoresheje iterambere rya chimie ihamye (acd / laboratwari) software v11.02 (© 1994-2023 acd
Umutungo | Agaciro | Inkomoko |
Agace k'amashanyarazi | 128 A2 | (1) acd |
(1) kubarwa ukoresheje iterambere rya chimie ihamye (acd / laboratwari) software v11.02 (© 1994-2023 acd
Spectra irahari
1 h nmr
13 c nmr