N-{[5-(1,3-benzothiazol-2-yl)-2-chlorophenyl]carbamothioyl}-1-benzofuran-2-carboxamide
Chemical Structure Depiction of
N-{[5-(1,3-benzothiazol-2-yl)-2-chlorophenyl]carbamothioyl}-1-benzofuran-2-carboxamide
N-{[5-(1,3-benzothiazol-2-yl)-2-chlorophenyl]carbamothioyl}-1-benzofuran-2-carboxamide
Compound characteristics
| Compound ID: | 4059-2081 |
| Compound Name: | N-{[5-(1,3-benzothiazol-2-yl)-2-chlorophenyl]carbamothioyl}-1-benzofuran-2-carboxamide |
| Molecular Weight: | 463.96 |
| Molecular Formula: | C23 H14 Cl N3 O2 S2 |
| Smiles: | c1ccc2c(c1)cc(C(NC(Nc1cc(ccc1[Cl])c1nc3ccccc3s1)=S)=O)o2 |
| Stereo: | ACHIRAL |
| logP: | 7.0873 |
| logD: | 7.085 |
| logSw: | -6.8469 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 50.284 |
| InChI Key: | IIULJGVBSVXWFV-UHFFFAOYSA-N |