N-{[3-(1,3-benzothiazol-2-yl)-4-chlorophenyl]carbamothioyl}-3-methyl-1-benzofuran-2-carboxamide
Chemical Structure Depiction of
N-{[3-(1,3-benzothiazol-2-yl)-4-chlorophenyl]carbamothioyl}-3-methyl-1-benzofuran-2-carboxamide
N-{[3-(1,3-benzothiazol-2-yl)-4-chlorophenyl]carbamothioyl}-3-methyl-1-benzofuran-2-carboxamide
Compound characteristics
| Compound ID: | 4059-2332 |
| Compound Name: | N-{[3-(1,3-benzothiazol-2-yl)-4-chlorophenyl]carbamothioyl}-3-methyl-1-benzofuran-2-carboxamide |
| Molecular Weight: | 477.99 |
| Molecular Formula: | C24 H16 Cl N3 O2 S2 |
| Smiles: | Cc1c2ccccc2oc1C(NC(Nc1ccc(c(c1)c1nc2ccccc2s1)[Cl])=S)=O |
| Stereo: | ACHIRAL |
| logP: | 7.3785 |
| logD: | 7.3775 |
| logSw: | -6.5295 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.215 |
| InChI Key: | VKFVNPPXKMKFNJ-UHFFFAOYSA-N |