methyl N-(1-{5-[2-(2-fluorophenyl)ethenyl]-3-methyl-1,2-oxazole-4-sulfonyl}piperidine-4-carbonyl)-N-phenyl-beta-alaninate
Chemical Structure Depiction of
methyl N-(1-{5-[2-(2-fluorophenyl)ethenyl]-3-methyl-1,2-oxazole-4-sulfonyl}piperidine-4-carbonyl)-N-phenyl-beta-alaninate
methyl N-(1-{5-[2-(2-fluorophenyl)ethenyl]-3-methyl-1,2-oxazole-4-sulfonyl}piperidine-4-carbonyl)-N-phenyl-beta-alaninate
Compound characteristics
| Compound ID: | G637-1270 |
| Compound Name: | methyl N-(1-{5-[2-(2-fluorophenyl)ethenyl]-3-methyl-1,2-oxazole-4-sulfonyl}piperidine-4-carbonyl)-N-phenyl-beta-alaninate |
| Molecular Weight: | 555.63 |
| Molecular Formula: | C28 H30 F N3 O6 S |
| Smiles: | Cc1c(c(/C=C/c2ccccc2F)on1)S(N1CCC(CC1)C(N(CCC(=O)OC)c1ccccc1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7664 |
| logD: | 3.7664 |
| logSw: | -3.9886 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 89.645 |
| InChI Key: | JEMLSNZCNYAZBD-UHFFFAOYSA-N |