methyl 2-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-7-cyclopropyl-1-ethyl-4-oxo-1,4-dihydropyrido[2,3-d]pyrimidine-5-carboxylate
Chemical Structure Depiction of
methyl 2-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-7-cyclopropyl-1-ethyl-4-oxo-1,4-dihydropyrido[2,3-d]pyrimidine-5-carboxylate
methyl 2-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-7-cyclopropyl-1-ethyl-4-oxo-1,4-dihydropyrido[2,3-d]pyrimidine-5-carboxylate
Compound characteristics
Compound ID: | G749-0150 |
Compound Name: | methyl 2-{[(2-chloro-4-fluorophenyl)methyl]sulfanyl}-7-cyclopropyl-1-ethyl-4-oxo-1,4-dihydropyrido[2,3-d]pyrimidine-5-carboxylate |
Molecular Weight: | 447.91 |
Molecular Formula: | C21 H19 Cl F N3 O3 S |
Smiles: | CCN1C(=NC(c2c(cc(C3CC3)nc12)C(=O)OC)=O)SCc1ccc(cc1[Cl])F |
Stereo: | ACHIRAL |
logP: | 5.39 |
logD: | 5.3899 |
logSw: | -6.1995 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 56.829 |
InChI Key: | LYZFGNZYVXWKFA-UHFFFAOYSA-N |