methyl 7-methyl-4-oxo-2-[(propan-2-yl)sulfanyl]-5-(pyridin-3-yl)-3,4,5,8-tetrahydropyrido[2,3-d]pyrimidine-6-carboxylate
Chemical Structure Depiction of
methyl 7-methyl-4-oxo-2-[(propan-2-yl)sulfanyl]-5-(pyridin-3-yl)-3,4,5,8-tetrahydropyrido[2,3-d]pyrimidine-6-carboxylate
methyl 7-methyl-4-oxo-2-[(propan-2-yl)sulfanyl]-5-(pyridin-3-yl)-3,4,5,8-tetrahydropyrido[2,3-d]pyrimidine-6-carboxylate
Compound characteristics
Compound ID: | C117-0661 |
Compound Name: | methyl 7-methyl-4-oxo-2-[(propan-2-yl)sulfanyl]-5-(pyridin-3-yl)-3,4,5,8-tetrahydropyrido[2,3-d]pyrimidine-6-carboxylate |
Molecular Weight: | 372.44 |
Molecular Formula: | C18 H20 N4 O3 S |
Smiles: | CC(C)SC1NC(C2C(C(=C(C)NC=2N=1)C(=O)OC)c1cccnc1)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 1.8129 |
logD: | 0.0144 |
logSw: | -1.8178 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 74.746 |
InChI Key: | ZKUNTQBUGSAWHO-CYBMUJFWSA-N |