N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(2-ethyl-2,3-dihydro-4H-1,4-benzoxazine-4-carbonyl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(2-ethyl-2,3-dihydro-4H-1,4-benzoxazine-4-carbonyl)piperidine-4-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(2-ethyl-2,3-dihydro-4H-1,4-benzoxazine-4-carbonyl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | E216-5474 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(2-ethyl-2,3-dihydro-4H-1,4-benzoxazine-4-carbonyl)piperidine-4-carboxamide |
| Molecular Weight: | 451.52 |
| Molecular Formula: | C25 H29 N3 O5 |
| Smiles: | CCC1CN(C(N2CCC(CC2)C(NCc2ccc3c(c2)OCO3)=O)=O)c2ccccc2O1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2702 |
| logD: | 3.2702 |
| logSw: | -3.3804 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.129 |
| InChI Key: | VIKPBYYENUCUKY-LJQANCHMSA-N |