N-[2-(azepan-1-yl)ethyl]-2-{1-[2-(4-methylphenyl)-1,3-benzoxazole-5-carbonyl]piperidin-4-yl}propanamide
Chemical Structure Depiction of
N-[2-(azepan-1-yl)ethyl]-2-{1-[2-(4-methylphenyl)-1,3-benzoxazole-5-carbonyl]piperidin-4-yl}propanamide
N-[2-(azepan-1-yl)ethyl]-2-{1-[2-(4-methylphenyl)-1,3-benzoxazole-5-carbonyl]piperidin-4-yl}propanamide
Compound characteristics
| Compound ID: | L249-1636 |
| Compound Name: | N-[2-(azepan-1-yl)ethyl]-2-{1-[2-(4-methylphenyl)-1,3-benzoxazole-5-carbonyl]piperidin-4-yl}propanamide |
| Molecular Weight: | 516.68 |
| Molecular Formula: | C31 H40 N4 O3 |
| Smiles: | CC(C1CCN(CC1)C(c1ccc2c(c1)nc(c1ccc(C)cc1)o2)=O)C(NCCN1CCCCCC1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4143 |
| logD: | 2.6316 |
| logSw: | -4.0881 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.265 |
| InChI Key: | XNEHBDRICUYNEN-QHCPKHFHSA-N |