ethyl 1-(5-{[3-(dimethylamino)propyl]amino}-6-oxo-6H-anthra[1,9-cd][1,2]oxazol-3-yl)piperidine-4-carboxylate
Chemical Structure Depiction of
ethyl 1-(5-{[3-(dimethylamino)propyl]amino}-6-oxo-6H-anthra[1,9-cd][1,2]oxazol-3-yl)piperidine-4-carboxylate
ethyl 1-(5-{[3-(dimethylamino)propyl]amino}-6-oxo-6H-anthra[1,9-cd][1,2]oxazol-3-yl)piperidine-4-carboxylate
Compound characteristics
| Compound ID: | C620-0692 |
| Compound Name: | ethyl 1-(5-{[3-(dimethylamino)propyl]amino}-6-oxo-6H-anthra[1,9-cd][1,2]oxazol-3-yl)piperidine-4-carboxylate |
| Molecular Weight: | 476.58 |
| Molecular Formula: | C27 H32 N4 O4 |
| Smiles: | CCOC(C1CCN(CC1)c1cc(c2C(c3ccccc3c3c2c1no3)=O)NCCCN(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5199 |
| logD: | 2.7325 |
| logSw: | -4.5029 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.602 |
| InChI Key: | BKQPEJKWSKGKLQ-UHFFFAOYSA-N |