N'-(benzenesulfonyl)-N-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)carbamothioyl]benzenecarboximidamide
Chemical Structure Depiction of
N'-(benzenesulfonyl)-N-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)carbamothioyl]benzenecarboximidamide
N'-(benzenesulfonyl)-N-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)carbamothioyl]benzenecarboximidamide
Compound characteristics
| Compound ID: | 0783-0179 |
| Compound Name: | N'-(benzenesulfonyl)-N-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)carbamothioyl]benzenecarboximidamide |
| Molecular Weight: | 505.62 |
| Molecular Formula: | C25 H23 N5 O3 S2 |
| Smiles: | CC1=C(C(N(c2ccccc2)N1C)=O)NC(NC(\c1ccccc1)=N/S(c1ccccc1)(=O)=O)=S |
| Stereo: | ACHIRAL |
| logP: | 2.9302 |
| logD: | 2.876 |
| logSw: | -3.5477 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.98 |
| InChI Key: | TVZKMJSWTIHPKZ-UHFFFAOYSA-N |