3-(2-chlorophenyl)-5-methyl-N-{[4-(piperidine-1-sulfonyl)phenyl]carbamothioyl}-1,2-oxazole-4-carboxamide
Chemical Structure Depiction of
3-(2-chlorophenyl)-5-methyl-N-{[4-(piperidine-1-sulfonyl)phenyl]carbamothioyl}-1,2-oxazole-4-carboxamide
3-(2-chlorophenyl)-5-methyl-N-{[4-(piperidine-1-sulfonyl)phenyl]carbamothioyl}-1,2-oxazole-4-carboxamide
Compound characteristics
| Compound ID: | C301-0640 |
| Compound Name: | 3-(2-chlorophenyl)-5-methyl-N-{[4-(piperidine-1-sulfonyl)phenyl]carbamothioyl}-1,2-oxazole-4-carboxamide |
| Molecular Weight: | 519.04 |
| Molecular Formula: | C23 H23 Cl N4 O4 S2 |
| Smiles: | Cc1c(C(NC(Nc2ccc(cc2)S(N2CCCCC2)(=O)=O)=S)=O)c(c2ccccc2[Cl])no1 |
| Stereo: | ACHIRAL |
| logP: | 4.3319 |
| logD: | 4.331 |
| logSw: | -4.7279 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.911 |
| InChI Key: | HWKQNGJBUIGPDS-UHFFFAOYSA-N |