2-[(3-chlorophenyl)sulfanyl]-5-(3,5-dimethylpiperidine-1-sulfonyl)-N-[(4-methylphenyl)methyl]benzamide
Chemical Structure Depiction of
2-[(3-chlorophenyl)sulfanyl]-5-(3,5-dimethylpiperidine-1-sulfonyl)-N-[(4-methylphenyl)methyl]benzamide
2-[(3-chlorophenyl)sulfanyl]-5-(3,5-dimethylpiperidine-1-sulfonyl)-N-[(4-methylphenyl)methyl]benzamide
Compound characteristics
| Compound ID: | K781-5320 |
| Compound Name: | 2-[(3-chlorophenyl)sulfanyl]-5-(3,5-dimethylpiperidine-1-sulfonyl)-N-[(4-methylphenyl)methyl]benzamide |
| Molecular Weight: | 543.15 |
| Molecular Formula: | C28 H31 Cl N2 O3 S2 |
| Smiles: | CC1CC(C)CN(C1)S(c1ccc(c(c1)C(NCc1ccc(C)cc1)=O)Sc1cccc(c1)[Cl])(=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 7.2762 |
| logD: | 7.2762 |
| logSw: | -6.2852 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.958 |
| InChI Key: | VWDDNCQAGQGREA-UHFFFAOYSA-N |