N-[(2,1,3-benzothiadiazol-4-yl)carbamothioyl]-2-chlorobenzamide
Chemical Structure Depiction of
N-[(2,1,3-benzothiadiazol-4-yl)carbamothioyl]-2-chlorobenzamide
N-[(2,1,3-benzothiadiazol-4-yl)carbamothioyl]-2-chlorobenzamide
Compound characteristics
| Compound ID: | 3820-3731 |
| Compound Name: | N-[(2,1,3-benzothiadiazol-4-yl)carbamothioyl]-2-chlorobenzamide |
| Molecular Weight: | 348.83 |
| Molecular Formula: | C14 H9 Cl N4 O S2 |
| Smiles: | c1ccc(c(c1)C(NC(Nc1cccc2c1nsn2)=S)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.1304 |
| logD: | 4.12 |
| logSw: | -4.5717 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.495 |
| InChI Key: | AOKRWOXSQYUYNN-UHFFFAOYSA-N |