3-(3-chloro-1H-1,2,4-triazol-1-yl)-N-(2,4-difluorophenyl)adamantane-1-carboxamide
Chemical Structure Depiction of
3-(3-chloro-1H-1,2,4-triazol-1-yl)-N-(2,4-difluorophenyl)adamantane-1-carboxamide
3-(3-chloro-1H-1,2,4-triazol-1-yl)-N-(2,4-difluorophenyl)adamantane-1-carboxamide
Compound characteristics
| Compound ID: | Y509-3434 |
| Compound Name: | 3-(3-chloro-1H-1,2,4-triazol-1-yl)-N-(2,4-difluorophenyl)adamantane-1-carboxamide |
| Molecular Weight: | 392.83 |
| Molecular Formula: | C19 H19 Cl F2 N4 O |
| Smiles: | C1C2CC3(CC1CC(C2)(C3)n1cnc(n1)[Cl])C(Nc1ccc(cc1F)F)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.4188 |
| logD: | 4.1516 |
| logSw: | -4.5734 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.997 |
| InChI Key: | ACDUOUPAFCPMJU-UHFFFAOYSA-N |