N-(2H-1,3-benzodioxol-5-yl)-2-[4-oxo-7-(pyrrolidin-1-yl)pyrimido[4,5-d]pyrimidin-3(4H)-yl]acetamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-2-[4-oxo-7-(pyrrolidin-1-yl)pyrimido[4,5-d]pyrimidin-3(4H)-yl]acetamide
N-(2H-1,3-benzodioxol-5-yl)-2-[4-oxo-7-(pyrrolidin-1-yl)pyrimido[4,5-d]pyrimidin-3(4H)-yl]acetamide
Compound characteristics
| Compound ID: | L391-0018 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-2-[4-oxo-7-(pyrrolidin-1-yl)pyrimido[4,5-d]pyrimidin-3(4H)-yl]acetamide |
| Molecular Weight: | 394.39 |
| Molecular Formula: | C19 H18 N6 O4 |
| Smiles: | C1CCN(C1)c1ncc2C(N(CC(Nc3ccc4c(c3)OCO4)=O)C=Nc2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.452 |
| logD: | 1.4519 |
| logSw: | -2.298 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.018 |
| InChI Key: | SAQUUZDOCFOGJM-UHFFFAOYSA-N |