3-(3-chloro-1H-1,2,4-triazol-1-yl)-N-[4-(dimethylamino)phenyl]adamantane-1-carboxamide
Chemical Structure Depiction of
3-(3-chloro-1H-1,2,4-triazol-1-yl)-N-[4-(dimethylamino)phenyl]adamantane-1-carboxamide
3-(3-chloro-1H-1,2,4-triazol-1-yl)-N-[4-(dimethylamino)phenyl]adamantane-1-carboxamide
Compound characteristics
| Compound ID: | 6049-2573 |
| Compound Name: | 3-(3-chloro-1H-1,2,4-triazol-1-yl)-N-[4-(dimethylamino)phenyl]adamantane-1-carboxamide |
| Molecular Weight: | 399.92 |
| Molecular Formula: | C21 H26 Cl N5 O |
| Smiles: | CN(C)c1ccc(cc1)NC(C12CC3CC(C1)CC(C3)(C2)n1cnc(n1)[Cl])=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.3947 |
| logD: | 4.3861 |
| logSw: | -4.4632 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.5 |
| InChI Key: | FAVBIHWNOYLCDG-UHFFFAOYSA-N |