3-(2-chlorophenyl)-N-{[4-(3,5-dimethylpiperidine-1-sulfonyl)phenyl]carbamothioyl}-5-methyl-1,2-oxazole-4-carboxamide
Chemical Structure Depiction of
3-(2-chlorophenyl)-N-{[4-(3,5-dimethylpiperidine-1-sulfonyl)phenyl]carbamothioyl}-5-methyl-1,2-oxazole-4-carboxamide
3-(2-chlorophenyl)-N-{[4-(3,5-dimethylpiperidine-1-sulfonyl)phenyl]carbamothioyl}-5-methyl-1,2-oxazole-4-carboxamide
Compound characteristics
| Compound ID: | C301-0641 |
| Compound Name: | 3-(2-chlorophenyl)-N-{[4-(3,5-dimethylpiperidine-1-sulfonyl)phenyl]carbamothioyl}-5-methyl-1,2-oxazole-4-carboxamide |
| Molecular Weight: | 547.09 |
| Molecular Formula: | C25 H27 Cl N4 O4 S2 |
| Smiles: | CC1CC(C)CN(C1)S(c1ccc(cc1)NC(NC(c1c(c2ccccc2[Cl])noc1C)=O)=S)(=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.2911 |
| logD: | 5.2903 |
| logSw: | -5.8398 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.778 |
| InChI Key: | OORSBRFOZWRHKZ-UHFFFAOYSA-N |