N-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-[5-(2,5-dimethylphenyl)-1,2-oxazole-3-carbonyl]valinamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-[5-(2,5-dimethylphenyl)-1,2-oxazole-3-carbonyl]valinamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-[5-(2,5-dimethylphenyl)-1,2-oxazole-3-carbonyl]valinamide
Compound characteristics
| Compound ID: | V002-8069 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-N~2~-[5-(2,5-dimethylphenyl)-1,2-oxazole-3-carbonyl]valinamide |
| Molecular Weight: | 449.51 |
| Molecular Formula: | C25 H27 N3 O5 |
| Smiles: | CC(C)C(C(NCc1ccc2c(c1)OCO2)=O)NC(c1cc(c2cc(C)ccc2C)on1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.237 |
| logD: | 4.237 |
| logSw: | -4.1574 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.34 |
| InChI Key: | CWHOXTCXRFHNTA-QHCPKHFHSA-N |