(4-chlorophenyl)[5-{[(4-fluorophenyl)methyl]amino}-3-(pyridin-3-yl)-1H-1,2,4-triazol-1-yl]methanone
Chemical Structure Depiction of
(4-chlorophenyl)[5-{[(4-fluorophenyl)methyl]amino}-3-(pyridin-3-yl)-1H-1,2,4-triazol-1-yl]methanone
(4-chlorophenyl)[5-{[(4-fluorophenyl)methyl]amino}-3-(pyridin-3-yl)-1H-1,2,4-triazol-1-yl]methanone
Compound characteristics
| Compound ID: | D116-0345 |
| Compound Name: | (4-chlorophenyl)[5-{[(4-fluorophenyl)methyl]amino}-3-(pyridin-3-yl)-1H-1,2,4-triazol-1-yl]methanone |
| Molecular Weight: | 407.83 |
| Molecular Formula: | C21 H15 Cl F N5 O |
| Smiles: | C(c1ccc(cc1)F)Nc1nc(c2cccnc2)nn1C(c1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.6301 |
| logD: | 3.4807 |
| logSw: | -4.2323 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.745 |
| InChI Key: | ASKCIRCWFQWVKI-UHFFFAOYSA-N |