3-(3-bromo-1H-1,2,4-triazol-1-yl)-N-[4-(methylsulfamoyl)phenyl]adamantane-1-carboxamide
Chemical Structure Depiction of
3-(3-bromo-1H-1,2,4-triazol-1-yl)-N-[4-(methylsulfamoyl)phenyl]adamantane-1-carboxamide
3-(3-bromo-1H-1,2,4-triazol-1-yl)-N-[4-(methylsulfamoyl)phenyl]adamantane-1-carboxamide
Compound characteristics
| Compound ID: | Y501-7453 |
| Compound Name: | 3-(3-bromo-1H-1,2,4-triazol-1-yl)-N-[4-(methylsulfamoyl)phenyl]adamantane-1-carboxamide |
| Molecular Weight: | 494.41 |
| Molecular Formula: | C20 H24 Br N5 O3 S |
| Smiles: | CNS(c1ccc(cc1)NC(C12CC3CC(C1)CC(C3)(C2)n1cnc(n1)[Br])=O)(=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.4563 |
| logD: | 3.4355 |
| logSw: | -3.9357 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.811 |
| InChI Key: | WCGMBRPMQWMESB-UHFFFAOYSA-N |