N-[1-(adamantan-1-yl)ethyl]-1-(2-methyl-2,3-dihydro-4H-1,4-benzoxazine-4-carbonyl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-[1-(adamantan-1-yl)ethyl]-1-(2-methyl-2,3-dihydro-4H-1,4-benzoxazine-4-carbonyl)piperidine-4-carboxamide
N-[1-(adamantan-1-yl)ethyl]-1-(2-methyl-2,3-dihydro-4H-1,4-benzoxazine-4-carbonyl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | E216-0678 |
| Compound Name: | N-[1-(adamantan-1-yl)ethyl]-1-(2-methyl-2,3-dihydro-4H-1,4-benzoxazine-4-carbonyl)piperidine-4-carboxamide |
| Molecular Weight: | 465.64 |
| Molecular Formula: | C28 H39 N3 O3 |
| Smiles: | CC(C12CC3CC(CC(C3)C2)C1)NC(C1CCN(CC1)C(N1CC(C)Oc2ccccc12)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.6192 |
| logD: | 4.6192 |
| logSw: | -4.2713 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.015 |
| InChI Key: | WJFGTXGTBBBKQH-UHFFFAOYSA-N |