1-[{[(1,3-benzothiazol-2-yl)sulfanyl]acetyl}(benzyl)amino]-N-(2,6-dimethylphenyl)-4-methylcyclohexane-1-carboxamide
Chemical Structure Depiction of
1-[{[(1,3-benzothiazol-2-yl)sulfanyl]acetyl}(benzyl)amino]-N-(2,6-dimethylphenyl)-4-methylcyclohexane-1-carboxamide
1-[{[(1,3-benzothiazol-2-yl)sulfanyl]acetyl}(benzyl)amino]-N-(2,6-dimethylphenyl)-4-methylcyclohexane-1-carboxamide
Compound characteristics
| Compound ID: | 8011-4768 |
| Compound Name: | 1-[{[(1,3-benzothiazol-2-yl)sulfanyl]acetyl}(benzyl)amino]-N-(2,6-dimethylphenyl)-4-methylcyclohexane-1-carboxamide |
| Molecular Weight: | 557.78 |
| Molecular Formula: | C32 H35 N3 O2 S2 |
| Smiles: | CC1CCC(CC1)(C(Nc1c(C)cccc1C)=O)N(Cc1ccccc1)C(CSc1nc2ccccc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 7.9778 |
| logD: | 7.9778 |
| logSw: | -5.6488 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.656 |
| InChI Key: | CURKUQVGWWPVTD-UHFFFAOYSA-N |