N-(2-{2-[(2H-1,3-benzodioxol-5-yl)methylidene]hydrazinyl}-2-oxoethyl)-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)benzenesulfonamide
Chemical Structure Depiction of
N-(2-{2-[(2H-1,3-benzodioxol-5-yl)methylidene]hydrazinyl}-2-oxoethyl)-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)benzenesulfonamide
N-(2-{2-[(2H-1,3-benzodioxol-5-yl)methylidene]hydrazinyl}-2-oxoethyl)-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)benzenesulfonamide
Compound characteristics
| Compound ID: | 3272-0508 |
| Compound Name: | N-(2-{2-[(2H-1,3-benzodioxol-5-yl)methylidene]hydrazinyl}-2-oxoethyl)-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)benzenesulfonamide |
| Molecular Weight: | 547.59 |
| Molecular Formula: | C27 H25 N5 O6 S |
| Smiles: | CC1=C(C(N(c2ccccc2)N1C)=O)N(CC(N/N=C/c1ccc2c(c1)OCO2)=O)S(c1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5801 |
| logD: | 2.58 |
| logSw: | -3.0921 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 104.382 |
| InChI Key: | QJGPWPKPCXNDTC-UHFFFAOYSA-N |