1-{[(3-amino-1H-1,2,4-triazol-5-yl)acetyl](benzyl)amino}-N-(2-methylphenyl)cyclohexane-1-carboxamide
Chemical Structure Depiction of
1-{[(3-amino-1H-1,2,4-triazol-5-yl)acetyl](benzyl)amino}-N-(2-methylphenyl)cyclohexane-1-carboxamide
1-{[(3-amino-1H-1,2,4-triazol-5-yl)acetyl](benzyl)amino}-N-(2-methylphenyl)cyclohexane-1-carboxamide
Compound characteristics
| Compound ID: | 8012-7898 |
| Compound Name: | 1-{[(3-amino-1H-1,2,4-triazol-5-yl)acetyl](benzyl)amino}-N-(2-methylphenyl)cyclohexane-1-carboxamide |
| Molecular Weight: | 446.55 |
| Molecular Formula: | C25 H30 N6 O2 |
| Smiles: | Cc1ccccc1NC(C1(CCCCC1)N(Cc1ccccc1)C(Cc1nc(N)n[nH]1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0426 |
| logD: | 4.0424 |
| logSw: | -4.2508 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 92.785 |
| InChI Key: | PRDSLTDBHZVUKR-UHFFFAOYSA-N |