1-(4-methylbenzene-1-sulfonyl)-3-(pyridin-3-yl)-N-[(thiophen-2-yl)methyl]-1H-1,2,4-triazol-5-amine
Chemical Structure Depiction of
1-(4-methylbenzene-1-sulfonyl)-3-(pyridin-3-yl)-N-[(thiophen-2-yl)methyl]-1H-1,2,4-triazol-5-amine
1-(4-methylbenzene-1-sulfonyl)-3-(pyridin-3-yl)-N-[(thiophen-2-yl)methyl]-1H-1,2,4-triazol-5-amine
Compound characteristics
| Compound ID: | D116-0204 |
| Compound Name: | 1-(4-methylbenzene-1-sulfonyl)-3-(pyridin-3-yl)-N-[(thiophen-2-yl)methyl]-1H-1,2,4-triazol-5-amine |
| Molecular Weight: | 411.5 |
| Molecular Formula: | C19 H17 N5 O2 S2 |
| Smiles: | Cc1ccc(cc1)S(n1c(NCc2cccs2)nc(c2cccnc2)n1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3054 |
| logD: | 2.9737 |
| logSw: | -3.4192 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.77 |
| InChI Key: | KVBDCSHKDYQLAM-UHFFFAOYSA-N |