2-{[3-(3-methylpiperidin-1-yl)-6-oxo-6H-anthra[1,9-cd][1,2]oxazol-5-yl]amino}ethyl acetate
Chemical Structure Depiction of
2-{[3-(3-methylpiperidin-1-yl)-6-oxo-6H-anthra[1,9-cd][1,2]oxazol-5-yl]amino}ethyl acetate
2-{[3-(3-methylpiperidin-1-yl)-6-oxo-6H-anthra[1,9-cd][1,2]oxazol-5-yl]amino}ethyl acetate
Compound characteristics
| Compound ID: | C620-0050 |
| Compound Name: | 2-{[3-(3-methylpiperidin-1-yl)-6-oxo-6H-anthra[1,9-cd][1,2]oxazol-5-yl]amino}ethyl acetate |
| Molecular Weight: | 419.48 |
| Molecular Formula: | C24 H25 N3 O4 |
| Smiles: | CC1CCCN(C1)c1cc(c2C(c3ccccc3c3c2c1no3)=O)NCCOC(C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.9651 |
| logD: | 4.9651 |
| logSw: | -4.8191 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.065 |
| InChI Key: | QWBXUMVLRGOHCJ-AWEZNQCLSA-N |