2-{[2-(4-methoxyphenyl)-6,8-dimethyl-5,7-dioxo-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4-yl]sulfanyl}butanoic acid
Chemical Structure Depiction of
2-{[2-(4-methoxyphenyl)-6,8-dimethyl-5,7-dioxo-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4-yl]sulfanyl}butanoic acid
2-{[2-(4-methoxyphenyl)-6,8-dimethyl-5,7-dioxo-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4-yl]sulfanyl}butanoic acid
Compound characteristics
| Compound ID: | C610-0170 |
| Compound Name: | 2-{[2-(4-methoxyphenyl)-6,8-dimethyl-5,7-dioxo-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4-yl]sulfanyl}butanoic acid |
| Molecular Weight: | 416.45 |
| Molecular Formula: | C19 H20 N4 O5 S |
| Smiles: | CCC(C(O)=O)Sc1c2C(N(C)C(N(C)c2nc(c2ccc(cc2)OC)n1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6476 |
| logD: | 0.4508 |
| logSw: | -4.1023 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.007 |
| InChI Key: | VIDFOAUYKYKLDX-LBPRGKRZSA-N |