3-(3-{4-hydroxy-4-[3-(trifluoromethyl)phenyl]piperidin-1-yl}-3-oxopropyl)-5-sulfanylidene-5,6-dihydroimidazo[1,2-c]quinazolin-2(3H)-one
Chemical Structure Depiction of
3-(3-{4-hydroxy-4-[3-(trifluoromethyl)phenyl]piperidin-1-yl}-3-oxopropyl)-5-sulfanylidene-5,6-dihydroimidazo[1,2-c]quinazolin-2(3H)-one
3-(3-{4-hydroxy-4-[3-(trifluoromethyl)phenyl]piperidin-1-yl}-3-oxopropyl)-5-sulfanylidene-5,6-dihydroimidazo[1,2-c]quinazolin-2(3H)-one
Compound characteristics
| Compound ID: | K279-0353 |
| Compound Name: | 3-(3-{4-hydroxy-4-[3-(trifluoromethyl)phenyl]piperidin-1-yl}-3-oxopropyl)-5-sulfanylidene-5,6-dihydroimidazo[1,2-c]quinazolin-2(3H)-one |
| Molecular Weight: | 516.54 |
| Molecular Formula: | C25 H23 F3 N4 O3 S |
| Smiles: | C(CC(N1CCC(CC1)(c1cccc(c1)C(F)(F)F)O)=O)C1C(N=C2c3ccccc3NC(N12)=S)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6305 |
| logD: | 2.1566 |
| logSw: | -3.3528 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.471 |
| InChI Key: | APTRSTSCRHALAU-LJQANCHMSA-N |