N-(1-{2-[4-(3-methylphenyl)piperazin-1-yl]-2-oxoethyl}-1H-1,2,4-triazol-3-yl)benzamide
Chemical Structure Depiction of
N-(1-{2-[4-(3-methylphenyl)piperazin-1-yl]-2-oxoethyl}-1H-1,2,4-triazol-3-yl)benzamide
N-(1-{2-[4-(3-methylphenyl)piperazin-1-yl]-2-oxoethyl}-1H-1,2,4-triazol-3-yl)benzamide
Compound characteristics
| Compound ID: | D524-1243 |
| Compound Name: | N-(1-{2-[4-(3-methylphenyl)piperazin-1-yl]-2-oxoethyl}-1H-1,2,4-triazol-3-yl)benzamide |
| Molecular Weight: | 404.47 |
| Molecular Formula: | C22 H24 N6 O2 |
| Smiles: | Cc1cccc(c1)N1CCN(CC1)C(Cn1cnc(NC(c2ccccc2)=O)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.254 |
| logD: | 2.0893 |
| logSw: | -3.0087 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.204 |
| InChI Key: | GRZHXAIAGQATIV-UHFFFAOYSA-N |