4-(4-{[3-bromo-4-(dimethylamino)phenyl]methylidene}-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)benzene-1-sulfonamide
Chemical Structure Depiction of
4-(4-{[3-bromo-4-(dimethylamino)phenyl]methylidene}-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)benzene-1-sulfonamide
4-(4-{[3-bromo-4-(dimethylamino)phenyl]methylidene}-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)benzene-1-sulfonamide
Compound characteristics
| Compound ID: | 3172-0711 |
| Compound Name: | 4-(4-{[3-bromo-4-(dimethylamino)phenyl]methylidene}-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)benzene-1-sulfonamide |
| Molecular Weight: | 463.35 |
| Molecular Formula: | C19 H19 Br N4 O3 S |
| Smiles: | CC1/C(=C/c2ccc(c(c2)[Br])N(C)C)C(N(c2ccc(cc2)S(N)(=O)=O)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6453 |
| logD: | 2.6443 |
| logSw: | -3.3221 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.694 |
| InChI Key: | QVEZWVHECCKLGP-UHFFFAOYSA-N |