methyl N-(1-{3-methyl-5-[2-(4-methylphenyl)ethenyl]-1,2-oxazole-4-sulfonyl}piperidine-4-carbonyl)-N-phenyl-beta-alaninate
Chemical Structure Depiction of
methyl N-(1-{3-methyl-5-[2-(4-methylphenyl)ethenyl]-1,2-oxazole-4-sulfonyl}piperidine-4-carbonyl)-N-phenyl-beta-alaninate
methyl N-(1-{3-methyl-5-[2-(4-methylphenyl)ethenyl]-1,2-oxazole-4-sulfonyl}piperidine-4-carbonyl)-N-phenyl-beta-alaninate
Compound characteristics
| Compound ID: | G637-0846 |
| Compound Name: | methyl N-(1-{3-methyl-5-[2-(4-methylphenyl)ethenyl]-1,2-oxazole-4-sulfonyl}piperidine-4-carbonyl)-N-phenyl-beta-alaninate |
| Molecular Weight: | 551.66 |
| Molecular Formula: | C29 H33 N3 O6 S |
| Smiles: | Cc1ccc(/C=C/c2c(c(C)no2)S(N2CCC(CC2)C(N(CCC(=O)OC)c2ccccc2)=O)(=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.1345 |
| logD: | 4.1345 |
| logSw: | -4.1417 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 89.645 |
| InChI Key: | CGJASMLFXBMDHY-UHFFFAOYSA-N |