1-[4-(5-methyl-4-{[(4-methylphenyl)sulfanyl]methyl}-1,3-oxazol-2-yl)benzoyl]piperidine-4-carboxamide
Chemical Structure Depiction of
1-[4-(5-methyl-4-{[(4-methylphenyl)sulfanyl]methyl}-1,3-oxazol-2-yl)benzoyl]piperidine-4-carboxamide
1-[4-(5-methyl-4-{[(4-methylphenyl)sulfanyl]methyl}-1,3-oxazol-2-yl)benzoyl]piperidine-4-carboxamide
Compound characteristics
| Compound ID: | E776-0197 |
| Compound Name: | 1-[4-(5-methyl-4-{[(4-methylphenyl)sulfanyl]methyl}-1,3-oxazol-2-yl)benzoyl]piperidine-4-carboxamide |
| Molecular Weight: | 449.57 |
| Molecular Formula: | C25 H27 N3 O3 S |
| Smiles: | Cc1ccc(cc1)SCc1c(C)oc(c2ccc(cc2)C(N2CCC(CC2)C(N)=O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.4564 |
| logD: | 3.4564 |
| logSw: | -3.4862 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.796 |
| InChI Key: | CCZIQPWDUDYGDX-UHFFFAOYSA-N |