1-{[(3-amino-1H-1,2,4-triazol-5-yl)acetyl](propyl)amino}-N-(2,6-dimethylphenyl)cyclohexane-1-carboxamide
Chemical Structure Depiction of
1-{[(3-amino-1H-1,2,4-triazol-5-yl)acetyl](propyl)amino}-N-(2,6-dimethylphenyl)cyclohexane-1-carboxamide
1-{[(3-amino-1H-1,2,4-triazol-5-yl)acetyl](propyl)amino}-N-(2,6-dimethylphenyl)cyclohexane-1-carboxamide
Compound characteristics
| Compound ID: | 8012-5090 |
| Compound Name: | 1-{[(3-amino-1H-1,2,4-triazol-5-yl)acetyl](propyl)amino}-N-(2,6-dimethylphenyl)cyclohexane-1-carboxamide |
| Molecular Weight: | 412.53 |
| Molecular Formula: | C22 H32 N6 O2 |
| Smiles: | CCCN(C(Cc1nc(N)n[nH]1)=O)C1(CCCCC1)C(Nc1c(C)cccc1C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2842 |
| logD: | 3.284 |
| logSw: | -3.289 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 92.337 |
| InChI Key: | PJKCSBWQCIVFQO-UHFFFAOYSA-N |