4-[(4-bromo-3-nitro-1H-pyrazol-1-yl)methyl]-N-(4-sulfamoylphenyl)benzamide
Chemical Structure Depiction of
4-[(4-bromo-3-nitro-1H-pyrazol-1-yl)methyl]-N-(4-sulfamoylphenyl)benzamide
4-[(4-bromo-3-nitro-1H-pyrazol-1-yl)methyl]-N-(4-sulfamoylphenyl)benzamide
Compound characteristics
| Compound ID: | Y501-3969 |
| Compound Name: | 4-[(4-bromo-3-nitro-1H-pyrazol-1-yl)methyl]-N-(4-sulfamoylphenyl)benzamide |
| Molecular Weight: | 480.29 |
| Molecular Formula: | C17 H14 Br N5 O5 S |
| Smiles: | C(c1ccc(cc1)C(Nc1ccc(cc1)S(N)(=O)=O)=O)n1cc(c(n1)[N+]([O-])=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 1.6175 |
| logD: | 1.5947 |
| logSw: | -2.4407 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 121.529 |
| InChI Key: | GKAPMVPBENZNDL-UHFFFAOYSA-N |