N-(5-chloro-2,4-dimethoxyphenyl)-2-[4-oxo-7-(pyrrolidin-1-yl)pyrimido[4,5-d]pyrimidin-3(4H)-yl]acetamide
Chemical Structure Depiction of
N-(5-chloro-2,4-dimethoxyphenyl)-2-[4-oxo-7-(pyrrolidin-1-yl)pyrimido[4,5-d]pyrimidin-3(4H)-yl]acetamide
N-(5-chloro-2,4-dimethoxyphenyl)-2-[4-oxo-7-(pyrrolidin-1-yl)pyrimido[4,5-d]pyrimidin-3(4H)-yl]acetamide
Compound characteristics
| Compound ID: | L391-0061 |
| Compound Name: | N-(5-chloro-2,4-dimethoxyphenyl)-2-[4-oxo-7-(pyrrolidin-1-yl)pyrimido[4,5-d]pyrimidin-3(4H)-yl]acetamide |
| Molecular Weight: | 444.88 |
| Molecular Formula: | C20 H21 Cl N6 O4 |
| Smiles: | COc1cc(c(cc1NC(CN1C=Nc2c(cnc(n2)N2CCCC2)C1=O)=O)[Cl])OC |
| Stereo: | ACHIRAL |
| logP: | 1.9177 |
| logD: | 1.9121 |
| logSw: | -3.1167 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.465 |
| InChI Key: | XPADKSCLZIPHER-UHFFFAOYSA-N |