methyl 7-(3,4-dichlorophenyl)-1-ethyl-4-oxo-2-sulfanyl-1,4-dihydropyrido[2,3-d]pyrimidine-5-carboxylate
Chemical Structure Depiction of
methyl 7-(3,4-dichlorophenyl)-1-ethyl-4-oxo-2-sulfanyl-1,4-dihydropyrido[2,3-d]pyrimidine-5-carboxylate
methyl 7-(3,4-dichlorophenyl)-1-ethyl-4-oxo-2-sulfanyl-1,4-dihydropyrido[2,3-d]pyrimidine-5-carboxylate
Compound characteristics
Compound ID: | Y504-7932 |
Compound Name: | methyl 7-(3,4-dichlorophenyl)-1-ethyl-4-oxo-2-sulfanyl-1,4-dihydropyrido[2,3-d]pyrimidine-5-carboxylate |
Molecular Weight: | 410.28 |
Molecular Formula: | C17 H13 Cl2 N3 O3 S |
Smiles: | CCN1C(=NC(c2c(cc(c3ccc(c(c3)[Cl])[Cl])nc12)C(=O)OC)=O)S |
Stereo: | ACHIRAL |
logP: | 4.7206 |
logD: | 1.193 |
logSw: | -5.1233 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 56.084 |
InChI Key: | XEZCUTGPOVGPPC-UHFFFAOYSA-N |