2-{[6,8-dimethyl-2-(2-methylpropyl)-5,7-dioxo-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4-yl]sulfanyl}-N-methyl-N-phenylacetamide
Chemical Structure Depiction of
2-{[6,8-dimethyl-2-(2-methylpropyl)-5,7-dioxo-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4-yl]sulfanyl}-N-methyl-N-phenylacetamide
2-{[6,8-dimethyl-2-(2-methylpropyl)-5,7-dioxo-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4-yl]sulfanyl}-N-methyl-N-phenylacetamide
Compound characteristics
| Compound ID: | G786-1765 |
| Compound Name: | 2-{[6,8-dimethyl-2-(2-methylpropyl)-5,7-dioxo-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4-yl]sulfanyl}-N-methyl-N-phenylacetamide |
| Molecular Weight: | 427.52 |
| Molecular Formula: | C21 H25 N5 O3 S |
| Smiles: | CC(C)Cc1nc2c(C(N(C)C(N2C)=O)=O)c(n1)SCC(N(C)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2205 |
| logD: | 3.2205 |
| logSw: | -3.5698 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.159 |
| InChI Key: | KGBCMPVMKUAIKG-UHFFFAOYSA-N |