3-chloro-N-[(4-methylphenyl)carbamothioyl]-1-benzothiophene-2-carboxamide
Chemical Structure Depiction of
3-chloro-N-[(4-methylphenyl)carbamothioyl]-1-benzothiophene-2-carboxamide
3-chloro-N-[(4-methylphenyl)carbamothioyl]-1-benzothiophene-2-carboxamide
Compound characteristics
| Compound ID: | 2279-2153 |
| Compound Name: | 3-chloro-N-[(4-methylphenyl)carbamothioyl]-1-benzothiophene-2-carboxamide |
| Molecular Weight: | 360.88 |
| Molecular Formula: | C17 H13 Cl N2 O S2 |
| Smiles: | Cc1ccc(cc1)NC(NC(c1c(c2ccccc2s1)[Cl])=O)=S |
| Stereo: | ACHIRAL |
| logP: | 5.4773 |
| logD: | 5.4763 |
| logSw: | -5.8461 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 33.986 |
| InChI Key: | SYXWSIMOAXURGA-UHFFFAOYSA-N |