2-(4-{4,7-dioxo-2-[(prop-2-yn-1-yl)sulfanyl]-3,4,5,6,7,8-hexahydropyrido[2,3-d]pyrimidin-5-yl}-2-methoxyphenoxy)acetamide
Chemical Structure Depiction of
2-(4-{4,7-dioxo-2-[(prop-2-yn-1-yl)sulfanyl]-3,4,5,6,7,8-hexahydropyrido[2,3-d]pyrimidin-5-yl}-2-methoxyphenoxy)acetamide
2-(4-{4,7-dioxo-2-[(prop-2-yn-1-yl)sulfanyl]-3,4,5,6,7,8-hexahydropyrido[2,3-d]pyrimidin-5-yl}-2-methoxyphenoxy)acetamide
Compound characteristics
| Compound ID: | D271-0346 |
| Compound Name: | 2-(4-{4,7-dioxo-2-[(prop-2-yn-1-yl)sulfanyl]-3,4,5,6,7,8-hexahydropyrido[2,3-d]pyrimidin-5-yl}-2-methoxyphenoxy)acetamide |
| Molecular Weight: | 414.44 |
| Molecular Formula: | C19 H18 N4 O5 S |
| Smiles: | COc1cc(ccc1OCC(N)=O)C1CC(NC2=C1C(NC(=N2)SCC#C)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | -0.4691 |
| logD: | -0.4868 |
| logSw: | -2.1629 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 106.744 |
| InChI Key: | NMEULJUTBRPMEX-LLVKDONJSA-N |