N-[3-(azepan-1-yl)propyl]-1-(2-ethyl-6-methyl-2,3-dihydro-4H-1,4-benzoxazine-4-carbonyl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-[3-(azepan-1-yl)propyl]-1-(2-ethyl-6-methyl-2,3-dihydro-4H-1,4-benzoxazine-4-carbonyl)piperidine-4-carboxamide
N-[3-(azepan-1-yl)propyl]-1-(2-ethyl-6-methyl-2,3-dihydro-4H-1,4-benzoxazine-4-carbonyl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | E216-5770 |
| Compound Name: | N-[3-(azepan-1-yl)propyl]-1-(2-ethyl-6-methyl-2,3-dihydro-4H-1,4-benzoxazine-4-carbonyl)piperidine-4-carboxamide |
| Molecular Weight: | 470.66 |
| Molecular Formula: | C27 H42 N4 O3 |
| Smiles: | CCC1CN(C(N2CCC(CC2)C(NCCCN2CCCCCC2)=O)=O)c2cc(C)ccc2O1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8862 |
| logD: | 1.2576 |
| logSw: | -3.6898 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.168 |
| InChI Key: | RLFGSPAAMDXLKI-HSZRJFAPSA-N |