7-(3,4-dichlorophenyl)-1-methyl-2-sulfanyl-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4(1H)-one
Chemical Structure Depiction of
7-(3,4-dichlorophenyl)-1-methyl-2-sulfanyl-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4(1H)-one
7-(3,4-dichlorophenyl)-1-methyl-2-sulfanyl-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4(1H)-one
Compound characteristics
Compound ID: | Y504-6813 |
Compound Name: | 7-(3,4-dichlorophenyl)-1-methyl-2-sulfanyl-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4(1H)-one |
Molecular Weight: | 406.21 |
Molecular Formula: | C15 H8 Cl2 F3 N3 O S |
Smiles: | CN1C(=NC(c2c(cc(c3ccc(c(c3)[Cl])[Cl])nc12)C(F)(F)F)=O)S |
Stereo: | ACHIRAL |
logP: | 5.0505 |
logD: | 1.0967 |
logSw: | -5.4781 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 34.951 |
InChI Key: | YWGOCXKARDAXFX-UHFFFAOYSA-N |