2-{[(2-chlorophenyl)methyl]sulfanyl}-3-phenyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Chemical Structure Depiction of
2-{[(2-chlorophenyl)methyl]sulfanyl}-3-phenyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
2-{[(2-chlorophenyl)methyl]sulfanyl}-3-phenyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Compound characteristics
Compound ID: | G856-0875 |
Compound Name: | 2-{[(2-chlorophenyl)methyl]sulfanyl}-3-phenyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one |
Molecular Weight: | 417.92 |
Molecular Formula: | C23 H16 Cl N3 O S |
Smiles: | C(c1ccccc1[Cl])SC1=Nc2c3ccccc3[nH]c2C(N1c1ccccc1)=O |
Stereo: | ACHIRAL |
logP: | 5.1872 |
logD: | 5.1872 |
logSw: | -5.6072 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 33.118 |
InChI Key: | AZKCSVKHORWOMM-UHFFFAOYSA-N |