3-(2-fluorophenyl)-2-[(3-phenylprop-2-en-1-yl)sulfanyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Chemical Structure Depiction of
3-(2-fluorophenyl)-2-[(3-phenylprop-2-en-1-yl)sulfanyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
3-(2-fluorophenyl)-2-[(3-phenylprop-2-en-1-yl)sulfanyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Compound characteristics
Compound ID: | G856-1319 |
Compound Name: | 3-(2-fluorophenyl)-2-[(3-phenylprop-2-en-1-yl)sulfanyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one |
Molecular Weight: | 427.5 |
Molecular Formula: | C25 H18 F N3 O S |
Smiles: | C(/C=C/c1ccccc1)SC1=Nc2c3ccccc3[nH]c2C(N1c1ccccc1F)=O |
Stereo: | ACHIRAL |
logP: | 5.4798 |
logD: | 5.4798 |
logSw: | -6.0313 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 32.817 |
InChI Key: | KNAHRLNBSBHJAX-UHFFFAOYSA-N |