1-(4-chlorobenzene-1-sulfonyl)-N-[(4-methoxyphenyl)methyl]-3-(pyridin-3-yl)-1H-1,2,4-triazol-5-amine
Chemical Structure Depiction of
1-(4-chlorobenzene-1-sulfonyl)-N-[(4-methoxyphenyl)methyl]-3-(pyridin-3-yl)-1H-1,2,4-triazol-5-amine
1-(4-chlorobenzene-1-sulfonyl)-N-[(4-methoxyphenyl)methyl]-3-(pyridin-3-yl)-1H-1,2,4-triazol-5-amine
Compound characteristics
| Compound ID: | D116-0319 |
| Compound Name: | 1-(4-chlorobenzene-1-sulfonyl)-N-[(4-methoxyphenyl)methyl]-3-(pyridin-3-yl)-1H-1,2,4-triazol-5-amine |
| Molecular Weight: | 455.92 |
| Molecular Formula: | C21 H18 Cl N5 O3 S |
| Smiles: | COc1ccc(CNc2nc(c3cccnc3)nn2S(c2ccc(cc2)[Cl])(=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.4841 |
| logD: | 3.1524 |
| logSw: | -4.0881 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.295 |
| InChI Key: | ANFMZQONEHRAOB-UHFFFAOYSA-N |