N-{[4-(carbamimidoylsulfamoyl)phenyl]carbamothioyl}-2-chlorobenzamide
Chemical Structure Depiction of
N-{[4-(carbamimidoylsulfamoyl)phenyl]carbamothioyl}-2-chlorobenzamide
N-{[4-(carbamimidoylsulfamoyl)phenyl]carbamothioyl}-2-chlorobenzamide
Compound characteristics
| Compound ID: | 8014-5153 |
| Compound Name: | N-{[4-(carbamimidoylsulfamoyl)phenyl]carbamothioyl}-2-chlorobenzamide |
| Molecular Weight: | 411.89 |
| Molecular Formula: | C15 H14 Cl N5 O3 S2 |
| Smiles: | c1ccc(c(c1)C(NC(Nc1ccc(cc1)S(NC(N)=N)(=O)=O)=S)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 1.5756 |
| logD: | 1.5756 |
| logSw: | -2.9408 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 6 |
| Polar surface area: | 113.814 |
| InChI Key: | JOONYMHXWGXVMU-UHFFFAOYSA-N |