N-[(3,4-dichlorophenyl)methyl]-5-(3,5-dimethylpiperidine-1-sulfonyl)-2-[(4-fluorophenyl)sulfanyl]benzamide
Chemical Structure Depiction of
N-[(3,4-dichlorophenyl)methyl]-5-(3,5-dimethylpiperidine-1-sulfonyl)-2-[(4-fluorophenyl)sulfanyl]benzamide
N-[(3,4-dichlorophenyl)methyl]-5-(3,5-dimethylpiperidine-1-sulfonyl)-2-[(4-fluorophenyl)sulfanyl]benzamide
Compound characteristics
| Compound ID: | K781-5219 |
| Compound Name: | N-[(3,4-dichlorophenyl)methyl]-5-(3,5-dimethylpiperidine-1-sulfonyl)-2-[(4-fluorophenyl)sulfanyl]benzamide |
| Molecular Weight: | 581.56 |
| Molecular Formula: | C27 H27 Cl2 F N2 O3 S2 |
| Smiles: | CC1CC(C)CN(C1)S(c1ccc(c(c1)C(NCc1ccc(c(c1)[Cl])[Cl])=O)Sc1ccc(cc1)F)(=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 7.8171 |
| logD: | 7.817 |
| logSw: | -6.572 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.958 |
| InChI Key: | BLQBTGWNZCTACR-UHFFFAOYSA-N |