{1-(4-chlorobenzoyl)-4-[3-(trifluoromethyl)phenyl]pyrrolidin-3-yl}(3,4-dihydroisoquinolin-2(1H)-yl)methanone
Chemical Structure Depiction of
{1-(4-chlorobenzoyl)-4-[3-(trifluoromethyl)phenyl]pyrrolidin-3-yl}(3,4-dihydroisoquinolin-2(1H)-yl)methanone
{1-(4-chlorobenzoyl)-4-[3-(trifluoromethyl)phenyl]pyrrolidin-3-yl}(3,4-dihydroisoquinolin-2(1H)-yl)methanone
Compound characteristics
| Compound ID: | V026-9108 |
| Compound Name: | {1-(4-chlorobenzoyl)-4-[3-(trifluoromethyl)phenyl]pyrrolidin-3-yl}(3,4-dihydroisoquinolin-2(1H)-yl)methanone |
| Molecular Weight: | 512.96 |
| Molecular Formula: | C28 H24 Cl F3 N2 O2 |
| Smiles: | C1CN(Cc2ccccc12)C(C1CN(CC1c1cccc(c1)C(F)(F)F)C(c1ccc(cc1)[Cl])=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.6722 |
| logD: | 5.6722 |
| logSw: | -6.2738 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 33.158 |
| InChI Key: | KGDOCGFEIWTLQO-UHFFFAOYSA-N |