N'-(4-chlorobenzene-1-sulfonyl)-N-[(3-methylphenyl)carbamothioyl]benzenecarboximidamide
Chemical Structure Depiction of
N'-(4-chlorobenzene-1-sulfonyl)-N-[(3-methylphenyl)carbamothioyl]benzenecarboximidamide
N'-(4-chlorobenzene-1-sulfonyl)-N-[(3-methylphenyl)carbamothioyl]benzenecarboximidamide
Compound characteristics
| Compound ID: | 2018-0189 |
| Compound Name: | N'-(4-chlorobenzene-1-sulfonyl)-N-[(3-methylphenyl)carbamothioyl]benzenecarboximidamide |
| Molecular Weight: | 443.97 |
| Molecular Formula: | C21 H18 Cl N3 O2 S2 |
| Smiles: | Cc1cccc(c1)NC(NC(/c1ccccc1)=N/S(c1ccc(cc1)[Cl])(=O)=O)=S |
| Stereo: | ACHIRAL |
| logP: | 5.4286 |
| logD: | 5.4283 |
| logSw: | -6.0391 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.599 |
| InChI Key: | ILOHERIJFBSBFA-UHFFFAOYSA-N |