2-{[2-(4-ethoxyphenyl)-6,8-dimethyl-5,7-dioxo-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4-yl]sulfanyl}-N,N-dimethyl-3-oxobutanamide
Chemical Structure Depiction of
2-{[2-(4-ethoxyphenyl)-6,8-dimethyl-5,7-dioxo-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4-yl]sulfanyl}-N,N-dimethyl-3-oxobutanamide
2-{[2-(4-ethoxyphenyl)-6,8-dimethyl-5,7-dioxo-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4-yl]sulfanyl}-N,N-dimethyl-3-oxobutanamide
Compound characteristics
| Compound ID: | G786-1852 |
| Compound Name: | 2-{[2-(4-ethoxyphenyl)-6,8-dimethyl-5,7-dioxo-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4-yl]sulfanyl}-N,N-dimethyl-3-oxobutanamide |
| Molecular Weight: | 471.53 |
| Molecular Formula: | C22 H25 N5 O5 S |
| Smiles: | CCOc1ccc(cc1)c1nc2c(C(N(C)C(N2C)=O)=O)c(n1)SC(C(C)=O)C(N(C)C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9225 |
| logD: | 2.8799 |
| logSw: | -3.1005 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 88.006 |
| InChI Key: | PAOXMTZBNNARKQ-INIZCTEOSA-N |