3-cyclopentyl-1-{6,7-dimethoxy-1-[3-(trifluoromethyl)phenyl]-3,4-dihydroisoquinolin-2(1H)-yl}propan-1-one
Chemical Structure Depiction of
3-cyclopentyl-1-{6,7-dimethoxy-1-[3-(trifluoromethyl)phenyl]-3,4-dihydroisoquinolin-2(1H)-yl}propan-1-one
3-cyclopentyl-1-{6,7-dimethoxy-1-[3-(trifluoromethyl)phenyl]-3,4-dihydroisoquinolin-2(1H)-yl}propan-1-one
Compound characteristics
| Compound ID: | V014-1363 |
| Compound Name: | 3-cyclopentyl-1-{6,7-dimethoxy-1-[3-(trifluoromethyl)phenyl]-3,4-dihydroisoquinolin-2(1H)-yl}propan-1-one |
| Molecular Weight: | 461.52 |
| Molecular Formula: | C26 H30 F3 N O3 |
| Smiles: | COc1cc2CCN(C(c3cccc(c3)C(F)(F)F)c2cc1OC)C(CCC1CCCC1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.6258 |
| logD: | 5.6258 |
| logSw: | -5.5846 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 31.1528 |
| InChI Key: | QEORDAXCPWXWTG-VWLOTQADSA-N |