4-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-1-sulfanylidene-3-[3-(trifluoromethyl)phenyl]-1H-[1,3]thiazolo[3,4-a]quinazolin-5(4H)-one
Chemical Structure Depiction of
4-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-1-sulfanylidene-3-[3-(trifluoromethyl)phenyl]-1H-[1,3]thiazolo[3,4-a]quinazolin-5(4H)-one
4-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-1-sulfanylidene-3-[3-(trifluoromethyl)phenyl]-1H-[1,3]thiazolo[3,4-a]quinazolin-5(4H)-one
Compound characteristics
Compound ID: | F369-0372 |
Compound Name: | 4-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]-1-sulfanylidene-3-[3-(trifluoromethyl)phenyl]-1H-[1,3]thiazolo[3,4-a]quinazolin-5(4H)-one |
Molecular Weight: | 517.59 |
Molecular Formula: | C25 H22 F3 N3 O2 S2 |
Smiles: | CC1CCN(CC1)C(CN1C2=C(c3cccc(c3)C(F)(F)F)SC(N2c2ccccc2C1=O)=S)=O |
Stereo: | ACHIRAL |
logP: | 5.0153 |
logD: | 5.0153 |
logSw: | -4.714 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 34.181 |
InChI Key: | WSCVTPOXGNZDPG-UHFFFAOYSA-N |