2-{1-[(2-chloro-4-fluorophenyl)methyl]-1H-indol-3-yl}-9-methyl-7-(trifluoromethyl)-2,3-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(1H)-one
Chemical Structure Depiction of
2-{1-[(2-chloro-4-fluorophenyl)methyl]-1H-indol-3-yl}-9-methyl-7-(trifluoromethyl)-2,3-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(1H)-one
2-{1-[(2-chloro-4-fluorophenyl)methyl]-1H-indol-3-yl}-9-methyl-7-(trifluoromethyl)-2,3-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(1H)-one
Compound characteristics
Compound ID: | Y509-0098 |
Compound Name: | 2-{1-[(2-chloro-4-fluorophenyl)methyl]-1H-indol-3-yl}-9-methyl-7-(trifluoromethyl)-2,3-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(1H)-one |
Molecular Weight: | 544.96 |
Molecular Formula: | C26 H17 Cl F4 N4 O S |
Smiles: | Cc1cc(C(F)(F)F)nc2c1c1c(C(NC(c3cn(Cc4ccc(cc4[Cl])F)c4ccccc34)N1)=O)s2 |
Stereo: | RACEMIC MIXTURE |
logP: | 6.2973 |
logD: | 6.2972 |
logSw: | -6.2403 |
Hydrogen bond acceptors count: | 3 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 45.577 |
InChI Key: | QOJYUWYOCHJEET-QHCPKHFHSA-N |