2-[7-(4-methoxyphenyl)-1-methyl-2,4-dioxo-1,4-dihydropyrimido[4,5-d]pyrimidin-3(2H)-yl]-N-[3-(pyrrolidin-1-yl)propyl]acetamide
Chemical Structure Depiction of
2-[7-(4-methoxyphenyl)-1-methyl-2,4-dioxo-1,4-dihydropyrimido[4,5-d]pyrimidin-3(2H)-yl]-N-[3-(pyrrolidin-1-yl)propyl]acetamide
2-[7-(4-methoxyphenyl)-1-methyl-2,4-dioxo-1,4-dihydropyrimido[4,5-d]pyrimidin-3(2H)-yl]-N-[3-(pyrrolidin-1-yl)propyl]acetamide
Compound characteristics
| Compound ID: | L558-0202 |
| Compound Name: | 2-[7-(4-methoxyphenyl)-1-methyl-2,4-dioxo-1,4-dihydropyrimido[4,5-d]pyrimidin-3(2H)-yl]-N-[3-(pyrrolidin-1-yl)propyl]acetamide |
| Molecular Weight: | 452.51 |
| Molecular Formula: | C23 H28 N6 O4 |
| Smiles: | CN1C(N(CC(NCCCN2CCCC2)=O)C(c2cnc(c3ccc(cc3)OC)nc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5295 |
| logD: | -1.561 |
| logSw: | -2.1958 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.614 |
| InChI Key: | KSZRPLOLBHOOKB-UHFFFAOYSA-N |