N-[1-(2-{[(4-methylphenyl)methyl]amino}-2-oxoethyl)-1H-1,2,4-triazol-3-yl]benzamide
Chemical Structure Depiction of
N-[1-(2-{[(4-methylphenyl)methyl]amino}-2-oxoethyl)-1H-1,2,4-triazol-3-yl]benzamide
N-[1-(2-{[(4-methylphenyl)methyl]amino}-2-oxoethyl)-1H-1,2,4-triazol-3-yl]benzamide
Compound characteristics
| Compound ID: | D524-1236 |
| Compound Name: | N-[1-(2-{[(4-methylphenyl)methyl]amino}-2-oxoethyl)-1H-1,2,4-triazol-3-yl]benzamide |
| Molecular Weight: | 349.39 |
| Molecular Formula: | C19 H19 N5 O2 |
| Smiles: | Cc1ccc(CNC(Cn2cnc(NC(c3ccccc3)=O)n2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.3688 |
| logD: | 2.2042 |
| logSw: | -2.8275 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.023 |
| InChI Key: | SUPVZJJMFPOMIL-UHFFFAOYSA-N |