[5-(benzylamino)-3-(pyridin-3-yl)-1H-1,2,4-triazol-1-yl](4-chlorophenyl)methanone
Chemical Structure Depiction of
[5-(benzylamino)-3-(pyridin-3-yl)-1H-1,2,4-triazol-1-yl](4-chlorophenyl)methanone
[5-(benzylamino)-3-(pyridin-3-yl)-1H-1,2,4-triazol-1-yl](4-chlorophenyl)methanone
Compound characteristics
| Compound ID: | D116-0269 |
| Compound Name: | [5-(benzylamino)-3-(pyridin-3-yl)-1H-1,2,4-triazol-1-yl](4-chlorophenyl)methanone |
| Molecular Weight: | 389.84 |
| Molecular Formula: | C21 H16 Cl N5 O |
| Smiles: | C(c1ccccc1)Nc1nc(c2cccnc2)nn1C(c1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.601 |
| logD: | 3.4517 |
| logSw: | -4.0693 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.745 |
| InChI Key: | NEMCPKCHOHUFCQ-UHFFFAOYSA-N |