ethyl 1-[5-(3-methoxyanilino)-6-oxo-6H-anthra[1,9-cd][1,2]oxazol-3-yl]piperidine-4-carboxylate
Chemical Structure Depiction of
ethyl 1-[5-(3-methoxyanilino)-6-oxo-6H-anthra[1,9-cd][1,2]oxazol-3-yl]piperidine-4-carboxylate
ethyl 1-[5-(3-methoxyanilino)-6-oxo-6H-anthra[1,9-cd][1,2]oxazol-3-yl]piperidine-4-carboxylate
Compound characteristics
| Compound ID: | C090-0013 |
| Compound Name: | ethyl 1-[5-(3-methoxyanilino)-6-oxo-6H-anthra[1,9-cd][1,2]oxazol-3-yl]piperidine-4-carboxylate |
| Molecular Weight: | 497.55 |
| Molecular Formula: | C29 H27 N3 O5 |
| Smiles: | CCOC(C1CCN(CC1)c1cc(c2C(c3ccccc3c3c2c1no3)=O)Nc1cccc(c1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 6.6825 |
| logD: | 6.6825 |
| logSw: | -6.0144 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.844 |
| InChI Key: | XKLYRWHYBCDBED-UHFFFAOYSA-N |