N-(4-methylphenyl)-3-(1H-1,2,4-triazol-1-yl)adamantane-1-carboxamide
Chemical Structure Depiction of
N-(4-methylphenyl)-3-(1H-1,2,4-triazol-1-yl)adamantane-1-carboxamide
N-(4-methylphenyl)-3-(1H-1,2,4-triazol-1-yl)adamantane-1-carboxamide
Compound characteristics
| Compound ID: | Y508-1996 |
| Compound Name: | N-(4-methylphenyl)-3-(1H-1,2,4-triazol-1-yl)adamantane-1-carboxamide |
| Molecular Weight: | 336.44 |
| Molecular Formula: | C20 H24 N4 O |
| Smiles: | Cc1ccc(cc1)NC(C12CC3CC(C1)CC(C3)(C2)n1cncn1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.0033 |
| logD: | 4.0032 |
| logSw: | -4.2975 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.85 |
| InChI Key: | NNZAVINNKQNQAQ-UHFFFAOYSA-N |