3-chloro-N-[(2-chlorophenyl)carbamothioyl]-1-benzothiophene-2-carboxamide
Chemical Structure Depiction of
3-chloro-N-[(2-chlorophenyl)carbamothioyl]-1-benzothiophene-2-carboxamide
3-chloro-N-[(2-chlorophenyl)carbamothioyl]-1-benzothiophene-2-carboxamide
Compound characteristics
| Compound ID: | 2043-8436 |
| Compound Name: | 3-chloro-N-[(2-chlorophenyl)carbamothioyl]-1-benzothiophene-2-carboxamide |
| Molecular Weight: | 381.3 |
| Molecular Formula: | C16 H10 Cl2 N2 O S2 |
| Smiles: | c1ccc(c(c1)NC(NC(c1c(c2ccccc2s1)[Cl])=O)=S)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.346 |
| logD: | 5.3376 |
| logSw: | -5.9073 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 33.289 |
| InChI Key: | WPSCMLGVDYEWOJ-UHFFFAOYSA-N |