N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[7-(4-chlorophenyl)-1-methyl-2,4-dioxo-1,4-dihydropyrimido[4,5-d]pyrimidin-3(2H)-yl]acetamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[7-(4-chlorophenyl)-1-methyl-2,4-dioxo-1,4-dihydropyrimido[4,5-d]pyrimidin-3(2H)-yl]acetamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[7-(4-chlorophenyl)-1-methyl-2,4-dioxo-1,4-dihydropyrimido[4,5-d]pyrimidin-3(2H)-yl]acetamide
Compound characteristics
| Compound ID: | L558-0557 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[7-(4-chlorophenyl)-1-methyl-2,4-dioxo-1,4-dihydropyrimido[4,5-d]pyrimidin-3(2H)-yl]acetamide |
| Molecular Weight: | 479.88 |
| Molecular Formula: | C23 H18 Cl N5 O5 |
| Smiles: | CN1C(N(CC(NCc2ccc3c(c2)OCO3)=O)C(c2cnc(c3ccc(cc3)[Cl])nc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2756 |
| logD: | 3.2756 |
| logSw: | -3.7395 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 92.995 |
| InChI Key: | SBFMPIHSGNAZPR-UHFFFAOYSA-N |