N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[4-oxo-7-(pyrrolidin-1-yl)pyrimido[4,5-d]pyrimidin-3(4H)-yl]acetamide
Chemical Structure Depiction of
N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[4-oxo-7-(pyrrolidin-1-yl)pyrimido[4,5-d]pyrimidin-3(4H)-yl]acetamide
N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[4-oxo-7-(pyrrolidin-1-yl)pyrimido[4,5-d]pyrimidin-3(4H)-yl]acetamide
Compound characteristics
| Compound ID: | L391-0059 |
| Compound Name: | N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[4-oxo-7-(pyrrolidin-1-yl)pyrimido[4,5-d]pyrimidin-3(4H)-yl]acetamide |
| Molecular Weight: | 452.82 |
| Molecular Formula: | C19 H16 Cl F3 N6 O2 |
| Smiles: | C1CCN(C1)c1ncc2C(N(CC(Nc3cc(ccc3[Cl])C(F)(F)F)=O)C=Nc2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8438 |
| logD: | 2.8199 |
| logSw: | -3.6197 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.204 |
| InChI Key: | WCXVVDPEUPFGIM-UHFFFAOYSA-N |