N-(2-{4-[(4-chlorophenyl)sulfanyl]-3,5-dimethyl-1H-pyrazol-1-yl}-2-oxoethyl)-4-fluorobenzene-1-sulfonamide
Chemical Structure Depiction of
N-(2-{4-[(4-chlorophenyl)sulfanyl]-3,5-dimethyl-1H-pyrazol-1-yl}-2-oxoethyl)-4-fluorobenzene-1-sulfonamide
N-(2-{4-[(4-chlorophenyl)sulfanyl]-3,5-dimethyl-1H-pyrazol-1-yl}-2-oxoethyl)-4-fluorobenzene-1-sulfonamide
Compound characteristics
| Compound ID: | 5795-0043 |
| Compound Name: | N-(2-{4-[(4-chlorophenyl)sulfanyl]-3,5-dimethyl-1H-pyrazol-1-yl}-2-oxoethyl)-4-fluorobenzene-1-sulfonamide |
| Molecular Weight: | 453.94 |
| Molecular Formula: | C19 H17 Cl F N3 O3 S2 |
| Smiles: | Cc1c(c(C)n(C(CNS(c2ccc(cc2)F)(=O)=O)=O)n1)Sc1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.5167 |
| logD: | 3.515 |
| logSw: | -4.0103 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.083 |
| InChI Key: | HBKMKVLYYDHYSD-UHFFFAOYSA-N |