2-[(6-{[3-(methylsulfanyl)phenyl]carbamamido}-1,3-benzothiazol-2-yl)sulfanyl]-N-phenylacetamide
Chemical Structure Depiction of
2-[(6-{[3-(methylsulfanyl)phenyl]carbamamido}-1,3-benzothiazol-2-yl)sulfanyl]-N-phenylacetamide
2-[(6-{[3-(methylsulfanyl)phenyl]carbamamido}-1,3-benzothiazol-2-yl)sulfanyl]-N-phenylacetamide
Compound characteristics
| Compound ID: | D451-0757 |
| Compound Name: | 2-[(6-{[3-(methylsulfanyl)phenyl]carbamamido}-1,3-benzothiazol-2-yl)sulfanyl]-N-phenylacetamide |
| Molecular Weight: | 480.63 |
| Molecular Formula: | C23 H20 N4 O2 S3 |
| Smiles: | CSc1cccc(c1)NC(Nc1ccc2c(c1)sc(n2)SCC(Nc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0594 |
| logD: | 6.0594 |
| logSw: | -5.4353 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 64.501 |
| InChI Key: | KKWLVBMPGHSPRP-UHFFFAOYSA-N |