ethyl 4-{4-[(3-fluorophenyl)methoxy]-3-methoxyphenyl}-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Chemical Structure Depiction of
ethyl 4-{4-[(3-fluorophenyl)methoxy]-3-methoxyphenyl}-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
ethyl 4-{4-[(3-fluorophenyl)methoxy]-3-methoxyphenyl}-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Compound characteristics
| Compound ID: | 3826-1187 |
| Compound Name: | ethyl 4-{4-[(3-fluorophenyl)methoxy]-3-methoxyphenyl}-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate |
| Molecular Weight: | 493.58 |
| Molecular Formula: | C29 H32 F N O5 |
| Smiles: | CCOC(C1C(C2=C(CC(C)(C)CC2=O)NC=1C)c1ccc(c(c1)OC)OCc1cccc(c1)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1925 |
| logD: | 0.9053 |
| logSw: | -5.2394 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.62 |
| InChI Key: | VNBAXXXDBVUELI-SANMLTNESA-N |