methyl 7-methyl-4-oxo-2-[(prop-2-en-1-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-[(prop-2-en-1-yl)sulfanyl]-5-(pyridin-3-yl)-3,4,5,8-tetrahydropyrido[2,3-d]pyrimidine-6-carboxylate
methyl 7-methyl-4-oxo-2-[(prop-2-en-1-yl)sulfanyl]-5-(pyridin-3-yl)-3,4,5,8-tetrahydropyrido[2,3-d]pyrimidine-6-carboxylate
Compound characteristics
| Compound ID: | C117-0721 |
| Compound Name: | methyl 7-methyl-4-oxo-2-[(prop-2-en-1-yl)sulfanyl]-5-(pyridin-3-yl)-3,4,5,8-tetrahydropyrido[2,3-d]pyrimidine-6-carboxylate |
| Molecular Weight: | 370.43 |
| Molecular Formula: | C18 H18 N4 O3 S |
| Smiles: | CC1=C(C(C2=C(N1)N=C(NC2=O)SCC=C)c1cccnc1)C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.6679 |
| logD: | 0.1213 |
| logSw: | -1.7724 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.746 |
| InChI Key: | GTHNEOOWZXFFLW-CYBMUJFWSA-N |