{4-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]phenyl}{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}methanone
Chemical Structure Depiction of
{4-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]phenyl}{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}methanone
{4-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]phenyl}{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}methanone
Compound characteristics
| Compound ID: | 7894-6124 |
| Compound Name: | {4-[(3,4-dihydroisoquinolin-2(1H)-yl)methyl]phenyl}{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}methanone |
| Molecular Weight: | 479.55 |
| Molecular Formula: | C28 H28 F3 N3 O |
| Smiles: | C1CN(Cc2ccc(cc2)C(N2CCN(CC2)c2cccc(c2)C(F)(F)F)=O)Cc2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 4.9597 |
| logD: | 4.6791 |
| logSw: | -4.9711 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 23.5415 |
| InChI Key: | MITOFCPPIKPOCV-UHFFFAOYSA-N |