2-{[2-(2,2-dimethylpropyl)-6,8-dimethyl-5,7-dioxo-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4-yl]sulfanyl}-N-(4-fluorophenyl)acetamide
Chemical Structure Depiction of
2-{[2-(2,2-dimethylpropyl)-6,8-dimethyl-5,7-dioxo-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4-yl]sulfanyl}-N-(4-fluorophenyl)acetamide
2-{[2-(2,2-dimethylpropyl)-6,8-dimethyl-5,7-dioxo-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4-yl]sulfanyl}-N-(4-fluorophenyl)acetamide
Compound characteristics
| Compound ID: | G786-1725 |
| Compound Name: | 2-{[2-(2,2-dimethylpropyl)-6,8-dimethyl-5,7-dioxo-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4-yl]sulfanyl}-N-(4-fluorophenyl)acetamide |
| Molecular Weight: | 445.51 |
| Molecular Formula: | C21 H24 F N5 O3 S |
| Smiles: | CC(C)(C)Cc1nc2c(C(N(C)C(N2C)=O)=O)c(n1)SCC(Nc1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.229 |
| logD: | 4.2289 |
| logSw: | -4.4554 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.195 |
| InChI Key: | SRYHTQPKPKHRRV-UHFFFAOYSA-N |