ethyl 4-{5-[2-amino-1-(4-bromo-2-methylphenyl)-3-cyano-5-oxo-1,4,5,6,7,8-hexahydroquinolin-4-yl]furan-2-yl}benzoate
Chemical Structure Depiction of
ethyl 4-{5-[2-amino-1-(4-bromo-2-methylphenyl)-3-cyano-5-oxo-1,4,5,6,7,8-hexahydroquinolin-4-yl]furan-2-yl}benzoate
ethyl 4-{5-[2-amino-1-(4-bromo-2-methylphenyl)-3-cyano-5-oxo-1,4,5,6,7,8-hexahydroquinolin-4-yl]furan-2-yl}benzoate
Compound characteristics
| Compound ID: | Y502-4706 |
| Compound Name: | ethyl 4-{5-[2-amino-1-(4-bromo-2-methylphenyl)-3-cyano-5-oxo-1,4,5,6,7,8-hexahydroquinolin-4-yl]furan-2-yl}benzoate |
| Molecular Weight: | 572.46 |
| Molecular Formula: | C30 H26 Br N3 O4 |
| Smiles: | CCOC(c1ccc(cc1)c1ccc(C2C(C#N)=C(N)N(C3CCCC(C2=3)=O)c2ccc(cc2C)[Br])o1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.4284 |
| logD: | 6.4284 |
| logSw: | -5.606 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.229 |
| InChI Key: | FAAXVCZHDAFJDO-HHHXNRCGSA-N |