7-(3,4-dichlorophenyl)-5-(difluoromethyl)-1-ethyl-2-sulfanylpyrido[2,3-d]pyrimidin-4(1H)-one
Chemical Structure Depiction of
7-(3,4-dichlorophenyl)-5-(difluoromethyl)-1-ethyl-2-sulfanylpyrido[2,3-d]pyrimidin-4(1H)-one
7-(3,4-dichlorophenyl)-5-(difluoromethyl)-1-ethyl-2-sulfanylpyrido[2,3-d]pyrimidin-4(1H)-one
Compound characteristics
| Compound ID: | Y504-7643 |
| Compound Name: | 7-(3,4-dichlorophenyl)-5-(difluoromethyl)-1-ethyl-2-sulfanylpyrido[2,3-d]pyrimidin-4(1H)-one |
| Molecular Weight: | 402.25 |
| Molecular Formula: | C16 H11 Cl2 F2 N3 O S |
| Smiles: | [H]C(c1cc(c2ccc(c(c2)[Cl])[Cl])nc2c1C(N=C(N2CC)S)=O)(F)F |
| Stereo: | ACHIRAL |
| logP: | 4.8646 |
| logD: | 1.3426 |
| logSw: | -5.2075 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 34.91 |
| InChI Key: | XZVYSOFQGQHBPN-UHFFFAOYSA-N |