methyl 2-{[1-(2-ethyl-2,3-dihydro-4H-1,4-benzoxazine-4-carbonyl)piperidine-4-carbonyl]amino}benzoate
Chemical Structure Depiction of
methyl 2-{[1-(2-ethyl-2,3-dihydro-4H-1,4-benzoxazine-4-carbonyl)piperidine-4-carbonyl]amino}benzoate
methyl 2-{[1-(2-ethyl-2,3-dihydro-4H-1,4-benzoxazine-4-carbonyl)piperidine-4-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | E216-5470 |
| Compound Name: | methyl 2-{[1-(2-ethyl-2,3-dihydro-4H-1,4-benzoxazine-4-carbonyl)piperidine-4-carbonyl]amino}benzoate |
| Molecular Weight: | 451.52 |
| Molecular Formula: | C25 H29 N3 O5 |
| Smiles: | CCC1CN(C(N2CCC(CC2)C(Nc2ccccc2C(=O)OC)=O)=O)c2ccccc2O1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6914 |
| logD: | 3.6231 |
| logSw: | -3.9496 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.167 |
| InChI Key: | SRXDJBZRFFUHDT-GOSISDBHSA-N |