N-{4-[(adamantan-1-yl)sulfamoyl]phenyl}-5-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]furan-2-carboxamide
Chemical Structure Depiction of
N-{4-[(adamantan-1-yl)sulfamoyl]phenyl}-5-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]furan-2-carboxamide
N-{4-[(adamantan-1-yl)sulfamoyl]phenyl}-5-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]furan-2-carboxamide
Compound characteristics
| Compound ID: | Y501-1043 |
| Compound Name: | N-{4-[(adamantan-1-yl)sulfamoyl]phenyl}-5-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]furan-2-carboxamide |
| Molecular Weight: | 587.54 |
| Molecular Formula: | C27 H31 Br N4 O4 S |
| Smiles: | Cc1c(c(C)n(Cc2ccc(C(Nc3ccc(cc3)S(NC34CC5CC(CC(C5)C4)C3)(=O)=O)=O)o2)n1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 4.9121 |
| logD: | 4.9078 |
| logSw: | -4.5715 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.12 |
| InChI Key: | XXCTYRVFCGPYSR-UHFFFAOYSA-N |