2-[4-(2-{[(2-methylphenyl)methyl]sulfanyl}-4,7-dioxo-3,4,5,6,7,8-hexahydropyrido[2,3-d]pyrimidin-5-yl)phenoxy]acetamide
Chemical Structure Depiction of
2-[4-(2-{[(2-methylphenyl)methyl]sulfanyl}-4,7-dioxo-3,4,5,6,7,8-hexahydropyrido[2,3-d]pyrimidin-5-yl)phenoxy]acetamide
2-[4-(2-{[(2-methylphenyl)methyl]sulfanyl}-4,7-dioxo-3,4,5,6,7,8-hexahydropyrido[2,3-d]pyrimidin-5-yl)phenoxy]acetamide
Compound characteristics
| Compound ID: | D392-0029 |
| Compound Name: | 2-[4-(2-{[(2-methylphenyl)methyl]sulfanyl}-4,7-dioxo-3,4,5,6,7,8-hexahydropyrido[2,3-d]pyrimidin-5-yl)phenoxy]acetamide |
| Molecular Weight: | 450.52 |
| Molecular Formula: | C23 H22 N4 O4 S |
| Smiles: | Cc1ccccc1CSC1NC(C2C(CC(NC=2N=1)=O)c1ccc(cc1)OCC(N)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.7529 |
| logD: | 1.7431 |
| logSw: | -2.3912 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 98.755 |
| InChI Key: | ORTJJFFCLYFJJJ-QGZVFWFLSA-N |