7-(3,4-dichlorophenyl)-5-(difluoromethyl)-1-(2-ethoxyphenyl)-2-sulfanylpyrido[2,3-d]pyrimidin-4(1H)-one
Chemical Structure Depiction of
7-(3,4-dichlorophenyl)-5-(difluoromethyl)-1-(2-ethoxyphenyl)-2-sulfanylpyrido[2,3-d]pyrimidin-4(1H)-one
7-(3,4-dichlorophenyl)-5-(difluoromethyl)-1-(2-ethoxyphenyl)-2-sulfanylpyrido[2,3-d]pyrimidin-4(1H)-one
Compound characteristics
| Compound ID: | Y504-6459 |
| Compound Name: | 7-(3,4-dichlorophenyl)-5-(difluoromethyl)-1-(2-ethoxyphenyl)-2-sulfanylpyrido[2,3-d]pyrimidin-4(1H)-one |
| Molecular Weight: | 494.35 |
| Molecular Formula: | C22 H15 Cl2 F2 N3 O2 S |
| Smiles: | [H]C(c1cc(c2ccc(c(c2)[Cl])[Cl])nc2c1C(N=C(N2c1ccccc1OCC)S)=O)(F)F |
| Stereo: | ACHIRAL |
| logP: | 6.0135 |
| logD: | 1.0445 |
| logSw: | -6.2434 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.211 |
| InChI Key: | MEKMICMTRYRQIP-UHFFFAOYSA-N |