2-{[1,3-dimethyl-6-(2-methylpropyl)-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidin-5-yl]sulfanyl}-N-[(oxolan-2-yl)methyl]acetamide
Chemical Structure Depiction of
2-{[1,3-dimethyl-6-(2-methylpropyl)-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidin-5-yl]sulfanyl}-N-[(oxolan-2-yl)methyl]acetamide
2-{[1,3-dimethyl-6-(2-methylpropyl)-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidin-5-yl]sulfanyl}-N-[(oxolan-2-yl)methyl]acetamide
Compound characteristics
Compound ID: | G721-0367 |
Compound Name: | 2-{[1,3-dimethyl-6-(2-methylpropyl)-2,4-dioxo-1,2,3,4-tetrahydropyrido[2,3-d]pyrimidin-5-yl]sulfanyl}-N-[(oxolan-2-yl)methyl]acetamide |
Molecular Weight: | 420.53 |
Molecular Formula: | C20 H28 N4 O4 S |
Smiles: | CC(C)Cc1cnc2c(C(N(C)C(N2C)=O)=O)c1SCC(NCC1CCCO1)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 1.965 |
logD: | 1.965 |
logSw: | -2.3626 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 74.616 |
InChI Key: | IWYWPXIQAYACGB-CQSZACIVSA-N |