(2-chlorophenyl)[3-(pyridin-3-yl)-5-{[(thiophen-2-yl)methyl]amino}-1H-1,2,4-triazol-1-yl]methanone
Chemical Structure Depiction of
(2-chlorophenyl)[3-(pyridin-3-yl)-5-{[(thiophen-2-yl)methyl]amino}-1H-1,2,4-triazol-1-yl]methanone
(2-chlorophenyl)[3-(pyridin-3-yl)-5-{[(thiophen-2-yl)methyl]amino}-1H-1,2,4-triazol-1-yl]methanone
Compound characteristics
| Compound ID: | D116-0198 |
| Compound Name: | (2-chlorophenyl)[3-(pyridin-3-yl)-5-{[(thiophen-2-yl)methyl]amino}-1H-1,2,4-triazol-1-yl]methanone |
| Molecular Weight: | 395.87 |
| Molecular Formula: | C19 H14 Cl N5 O S |
| Smiles: | C(c1cccs1)Nc1nc(c2cccnc2)nn1C(c1ccccc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.2546 |
| logD: | 3.1053 |
| logSw: | -3.9423 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.763 |
| InChI Key: | CPWZVLGHGXVBMK-UHFFFAOYSA-N |