3-{2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}-1-methyl-7-(4-methylphenyl)pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
3-{2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}-1-methyl-7-(4-methylphenyl)pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
3-{2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}-1-methyl-7-(4-methylphenyl)pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | L558-0948 |
| Compound Name: | 3-{2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}-1-methyl-7-(4-methylphenyl)pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 498.58 |
| Molecular Formula: | C28 H30 N6 O3 |
| Smiles: | Cc1ccc(cc1)c1ncc2C(N(CC(N3CCN(CC3)c3cccc(C)c3C)=O)C(N(C)c2n1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3007 |
| logD: | 4.3006 |
| logSw: | -4.2092 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 70.76 |
| InChI Key: | BFDSLCBUBORKSJ-UHFFFAOYSA-N |