N-{1-[2-(2-methylanilino)-2-oxoethyl]-1H-1,2,4-triazol-3-yl}benzamide
Chemical Structure Depiction of
N-{1-[2-(2-methylanilino)-2-oxoethyl]-1H-1,2,4-triazol-3-yl}benzamide
N-{1-[2-(2-methylanilino)-2-oxoethyl]-1H-1,2,4-triazol-3-yl}benzamide
Compound characteristics
| Compound ID: | D524-1227 |
| Compound Name: | N-{1-[2-(2-methylanilino)-2-oxoethyl]-1H-1,2,4-triazol-3-yl}benzamide |
| Molecular Weight: | 335.36 |
| Molecular Formula: | C18 H17 N5 O2 |
| Smiles: | Cc1ccccc1NC(Cn1cnc(NC(c2ccccc2)=O)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1625 |
| logD: | 1.9979 |
| logSw: | -2.638 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.003 |
| InChI Key: | LHIJTYIJCYAMBW-UHFFFAOYSA-N |