ethyl 1-{N-[(oxolan-2-yl)methyl]-N-[5-(2,4,6-trimethylphenyl)-1,2-oxazole-3-carbonyl]-beta-alanyl}piperidine-3-carboxylate
Chemical Structure Depiction of
ethyl 1-{N-[(oxolan-2-yl)methyl]-N-[5-(2,4,6-trimethylphenyl)-1,2-oxazole-3-carbonyl]-beta-alanyl}piperidine-3-carboxylate
ethyl 1-{N-[(oxolan-2-yl)methyl]-N-[5-(2,4,6-trimethylphenyl)-1,2-oxazole-3-carbonyl]-beta-alanyl}piperidine-3-carboxylate
Compound characteristics
| Compound ID: | V003-3051 |
| Compound Name: | ethyl 1-{N-[(oxolan-2-yl)methyl]-N-[5-(2,4,6-trimethylphenyl)-1,2-oxazole-3-carbonyl]-beta-alanyl}piperidine-3-carboxylate |
| Molecular Weight: | 525.65 |
| Molecular Formula: | C29 H39 N3 O6 |
| Smiles: | CCOC(C1CCCN(C1)C(CCN(CC1CCCO1)C(c1cc(c2c(C)cc(C)cc2C)on1)=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.8109 |
| logD: | 3.8109 |
| logSw: | -3.9288 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 83.425 |
| InChI Key: | XNVZOJANXKOVSV-UHFFFAOYSA-N |