1-{5-[2-(2,5-dimethylphenyl)ethenyl]-3-methyl-1,2-oxazole-4-sulfonyl}-N-[3-(methylsulfanyl)phenyl]piperidine-3-carboxamide
Chemical Structure Depiction of
1-{5-[2-(2,5-dimethylphenyl)ethenyl]-3-methyl-1,2-oxazole-4-sulfonyl}-N-[3-(methylsulfanyl)phenyl]piperidine-3-carboxamide
1-{5-[2-(2,5-dimethylphenyl)ethenyl]-3-methyl-1,2-oxazole-4-sulfonyl}-N-[3-(methylsulfanyl)phenyl]piperidine-3-carboxamide
Compound characteristics
| Compound ID: | F061-1404 |
| Compound Name: | 1-{5-[2-(2,5-dimethylphenyl)ethenyl]-3-methyl-1,2-oxazole-4-sulfonyl}-N-[3-(methylsulfanyl)phenyl]piperidine-3-carboxamide |
| Molecular Weight: | 525.69 |
| Molecular Formula: | C27 H31 N3 O4 S2 |
| Smiles: | Cc1ccc(C)c(/C=C/c2c(c(C)no2)S(N2CCCC(C2)C(Nc2cccc(c2)SC)=O)(=O)=O)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7774 |
| logD: | 4.7774 |
| logSw: | -4.4457 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.49 |
| InChI Key: | LDOIQBRGKMVUOS-QFIPXVFZSA-N |