[5-(2,3-dihydro-1,4-benzodioxin-6-yl)thiophen-2-yl][1-(4-fluorophenyl)-3,4-dihydroisoquinolin-2(1H)-yl]methanone
Chemical Structure Depiction of
[5-(2,3-dihydro-1,4-benzodioxin-6-yl)thiophen-2-yl][1-(4-fluorophenyl)-3,4-dihydroisoquinolin-2(1H)-yl]methanone
[5-(2,3-dihydro-1,4-benzodioxin-6-yl)thiophen-2-yl][1-(4-fluorophenyl)-3,4-dihydroisoquinolin-2(1H)-yl]methanone
Compound characteristics
| Compound ID: | V013-8291 |
| Compound Name: | [5-(2,3-dihydro-1,4-benzodioxin-6-yl)thiophen-2-yl][1-(4-fluorophenyl)-3,4-dihydroisoquinolin-2(1H)-yl]methanone |
| Molecular Weight: | 471.55 |
| Molecular Formula: | C28 H22 F N O3 S |
| Smiles: | C1CN(C(c2ccc(cc2)F)c2ccccc12)C(c1ccc(c2ccc3c(c2)OCCO3)s1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.1473 |
| logD: | 6.1473 |
| logSw: | -6.1433 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 32.431 |
| InChI Key: | AGLJYGSRPHTQPF-MHZLTWQESA-N |