methyl 2-{[1-(2-methyl-2,3-dihydro-4H-1,4-benzoxazine-4-carbonyl)piperidine-4-carbonyl]amino}benzoate
Chemical Structure Depiction of
methyl 2-{[1-(2-methyl-2,3-dihydro-4H-1,4-benzoxazine-4-carbonyl)piperidine-4-carbonyl]amino}benzoate
methyl 2-{[1-(2-methyl-2,3-dihydro-4H-1,4-benzoxazine-4-carbonyl)piperidine-4-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | E216-0588 |
| Compound Name: | methyl 2-{[1-(2-methyl-2,3-dihydro-4H-1,4-benzoxazine-4-carbonyl)piperidine-4-carbonyl]amino}benzoate |
| Molecular Weight: | 437.49 |
| Molecular Formula: | C24 H27 N3 O5 |
| Smiles: | CC1CN(C(N2CCC(CC2)C(Nc2ccccc2C(=O)OC)=O)=O)c2ccccc2O1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3108 |
| logD: | 3.2425 |
| logSw: | -3.75 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.973 |
| InChI Key: | MSNAAMWSFMXEEQ-MRXNPFEDSA-N |