2-(4-{1-methyl-4,7-dioxo-2-[(prop-2-en-1-yl)sulfanyl]-1,4,5,6,7,8-hexahydropyrido[2,3-d]pyrimidin-5-yl}phenoxy)acetamide
Chemical Structure Depiction of
2-(4-{1-methyl-4,7-dioxo-2-[(prop-2-en-1-yl)sulfanyl]-1,4,5,6,7,8-hexahydropyrido[2,3-d]pyrimidin-5-yl}phenoxy)acetamide
2-(4-{1-methyl-4,7-dioxo-2-[(prop-2-en-1-yl)sulfanyl]-1,4,5,6,7,8-hexahydropyrido[2,3-d]pyrimidin-5-yl}phenoxy)acetamide
Compound characteristics
| Compound ID: | D392-0908 |
| Compound Name: | 2-(4-{1-methyl-4,7-dioxo-2-[(prop-2-en-1-yl)sulfanyl]-1,4,5,6,7,8-hexahydropyrido[2,3-d]pyrimidin-5-yl}phenoxy)acetamide |
| Molecular Weight: | 400.45 |
| Molecular Formula: | C19 H20 N4 O4 S |
| Smiles: | CN1C2=C(C(CC(N2)=O)c2ccc(cc2)OCC(N)=O)C(N=C1SCC=C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.4551 |
| logD: | 0.355 |
| logSw: | -2.1428 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 91.241 |
| InChI Key: | IUPRLZJQOOKMRL-ZDUSSCGKSA-N |