ethyl 4-(3,4-dihydroisoquinolin-2(1H)-yl)-2-(trifluoromethyl)quinazoline-6-carboxylate
Chemical Structure Depiction of
ethyl 4-(3,4-dihydroisoquinolin-2(1H)-yl)-2-(trifluoromethyl)quinazoline-6-carboxylate
ethyl 4-(3,4-dihydroisoquinolin-2(1H)-yl)-2-(trifluoromethyl)quinazoline-6-carboxylate
Compound characteristics
Compound ID: | 7706-1025 |
Compound Name: | ethyl 4-(3,4-dihydroisoquinolin-2(1H)-yl)-2-(trifluoromethyl)quinazoline-6-carboxylate |
Molecular Weight: | 401.39 |
Molecular Formula: | C21 H18 F3 N3 O2 |
Smiles: | CCOC(c1ccc2c(c1)c(nc(C(F)(F)F)n2)N1CCc2ccccc2C1)=O |
Stereo: | ACHIRAL |
logP: | 5.6487 |
logD: | 5.6487 |
logSw: | -5.688 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 42.326 |
InChI Key: | AHUKUJHEXYJWPR-UHFFFAOYSA-N |