methyl 5-(6-methoxy-1-{5-[2-(trifluoromethyl)phenyl]furan-2-yl}-1,3,4,9-tetrahydro-2H-pyrido[3,4-b]indol-2-yl)-5-oxopentanoate
Chemical Structure Depiction of
methyl 5-(6-methoxy-1-{5-[2-(trifluoromethyl)phenyl]furan-2-yl}-1,3,4,9-tetrahydro-2H-pyrido[3,4-b]indol-2-yl)-5-oxopentanoate
methyl 5-(6-methoxy-1-{5-[2-(trifluoromethyl)phenyl]furan-2-yl}-1,3,4,9-tetrahydro-2H-pyrido[3,4-b]indol-2-yl)-5-oxopentanoate
Compound characteristics
| Compound ID: | V006-7693 |
| Compound Name: | methyl 5-(6-methoxy-1-{5-[2-(trifluoromethyl)phenyl]furan-2-yl}-1,3,4,9-tetrahydro-2H-pyrido[3,4-b]indol-2-yl)-5-oxopentanoate |
| Molecular Weight: | 540.54 |
| Molecular Formula: | C29 H27 F3 N2 O5 |
| Smiles: | COC(CCCC(N1CCc2c3cc(ccc3[nH]c2C1c1ccc(c2ccccc2C(F)(F)F)o1)OC)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.5429 |
| logD: | 5.5429 |
| logSw: | -5.5577 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.338 |
| InChI Key: | ZJWOSSALAJPSMU-NDEPHWFRSA-N |