methyl 2-{[1-(3-oxo-3,4-dihydroquinoxalin-2-yl)piperidine-3-carbonyl]amino}benzoate
Chemical Structure Depiction of
methyl 2-{[1-(3-oxo-3,4-dihydroquinoxalin-2-yl)piperidine-3-carbonyl]amino}benzoate
methyl 2-{[1-(3-oxo-3,4-dihydroquinoxalin-2-yl)piperidine-3-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | F681-0646 |
| Compound Name: | methyl 2-{[1-(3-oxo-3,4-dihydroquinoxalin-2-yl)piperidine-3-carbonyl]amino}benzoate |
| Molecular Weight: | 406.44 |
| Molecular Formula: | C22 H22 N4 O4 |
| Smiles: | COC(c1ccccc1NC(C1CCCN(C1)C1C(Nc2ccccc2N=1)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2766 |
| logD: | 2.197 |
| logSw: | -3.0498 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.496 |
| InChI Key: | MBCJRHPGBLHJGW-AWEZNQCLSA-N |