N-(2-methylphenyl)-2-[(6-{[3-(methylsulfanyl)phenyl]carbamamido}-1,3-benzothiazol-2-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(2-methylphenyl)-2-[(6-{[3-(methylsulfanyl)phenyl]carbamamido}-1,3-benzothiazol-2-yl)sulfanyl]acetamide
N-(2-methylphenyl)-2-[(6-{[3-(methylsulfanyl)phenyl]carbamamido}-1,3-benzothiazol-2-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | D451-0804 |
| Compound Name: | N-(2-methylphenyl)-2-[(6-{[3-(methylsulfanyl)phenyl]carbamamido}-1,3-benzothiazol-2-yl)sulfanyl]acetamide |
| Molecular Weight: | 494.66 |
| Molecular Formula: | C24 H22 N4 O2 S3 |
| Smiles: | Cc1ccccc1NC(CSc1nc2ccc(cc2s1)NC(Nc1cccc(c1)SC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0459 |
| logD: | 6.0459 |
| logSw: | -5.4164 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 63.803 |
| InChI Key: | IFRWTQBIGFXBCO-UHFFFAOYSA-N |