(azepan-1-yl)[2-(2H-1,3-benzodioxol-5-yl)quinolin-4-yl]methanone
Chemical Structure Depiction of
(azepan-1-yl)[2-(2H-1,3-benzodioxol-5-yl)quinolin-4-yl]methanone
(azepan-1-yl)[2-(2H-1,3-benzodioxol-5-yl)quinolin-4-yl]methanone
Compound characteristics
Compound ID: | Y509-0479 |
Compound Name: | (azepan-1-yl)[2-(2H-1,3-benzodioxol-5-yl)quinolin-4-yl]methanone |
Molecular Weight: | 374.44 |
Molecular Formula: | C23 H22 N2 O3 |
Smiles: | C1CCCN(CC1)C(c1cc(c2ccc3c(c2)OCO3)nc2ccccc12)=O |
Stereo: | ACHIRAL |
logP: | 5.0762 |
logD: | 5.0722 |
logSw: | -5.1188 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 42.392 |
InChI Key: | RHJIUFGKLFWNFR-UHFFFAOYSA-N |