1-[1-(2-chloro-6-fluorophenyl)-6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl]-2-(thiophen-2-yl)ethan-1-one
Chemical Structure Depiction of
1-[1-(2-chloro-6-fluorophenyl)-6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl]-2-(thiophen-2-yl)ethan-1-one
1-[1-(2-chloro-6-fluorophenyl)-6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl]-2-(thiophen-2-yl)ethan-1-one
Compound characteristics
| Compound ID: | V008-1088 |
| Compound Name: | 1-[1-(2-chloro-6-fluorophenyl)-6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl]-2-(thiophen-2-yl)ethan-1-one |
| Molecular Weight: | 445.94 |
| Molecular Formula: | C23 H21 Cl F N O3 S |
| Smiles: | COc1cc2CCN(C(c2cc1OC)c1c(cccc1[Cl])F)C(Cc1cccs1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.231 |
| logD: | 4.231 |
| logSw: | -4.5015 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 31.6131 |
| InChI Key: | RHBHJMZPJQUKAF-QHCPKHFHSA-N |