N-{[4-(carbamimidoylsulfamoyl)phenyl]carbamothioyl}-3,4-dimethoxybenzamide
Chemical Structure Depiction of
N-{[4-(carbamimidoylsulfamoyl)phenyl]carbamothioyl}-3,4-dimethoxybenzamide
N-{[4-(carbamimidoylsulfamoyl)phenyl]carbamothioyl}-3,4-dimethoxybenzamide
Compound characteristics
| Compound ID: | 5182-3104 |
| Compound Name: | N-{[4-(carbamimidoylsulfamoyl)phenyl]carbamothioyl}-3,4-dimethoxybenzamide |
| Molecular Weight: | 437.49 |
| Molecular Formula: | C17 H19 N5 O5 S2 |
| Smiles: | COc1ccc(cc1OC)C(NC(Nc1ccc(cc1)S(NC(N)=N)(=O)=O)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 0.7447 |
| logD: | 0.7447 |
| logSw: | -2.2194 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 6 |
| Polar surface area: | 129.075 |
| InChI Key: | HLIYBGCHJDHXTM-UHFFFAOYSA-N |