4-methyl-N-[2-({2-oxo-2-[4-(propan-2-yl)anilino]ethyl}sulfanyl)-1,3-benzothiazol-6-yl]benzamide
Chemical Structure Depiction of
4-methyl-N-[2-({2-oxo-2-[4-(propan-2-yl)anilino]ethyl}sulfanyl)-1,3-benzothiazol-6-yl]benzamide
4-methyl-N-[2-({2-oxo-2-[4-(propan-2-yl)anilino]ethyl}sulfanyl)-1,3-benzothiazol-6-yl]benzamide
Compound characteristics
| Compound ID: | 8008-8629 |
| Compound Name: | 4-methyl-N-[2-({2-oxo-2-[4-(propan-2-yl)anilino]ethyl}sulfanyl)-1,3-benzothiazol-6-yl]benzamide |
| Molecular Weight: | 475.63 |
| Molecular Formula: | C26 H25 N3 O2 S2 |
| Smiles: | CC(C)c1ccc(cc1)NC(CSc1nc2ccc(cc2s1)NC(c1ccc(C)cc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.9012 |
| logD: | 6.9004 |
| logSw: | -5.529 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.289 |
| InChI Key: | NKEMDEZJSZRKTA-UHFFFAOYSA-N |