1-methyl-7-(4-methylphenyl)-3-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
1-methyl-7-(4-methylphenyl)-3-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
1-methyl-7-(4-methylphenyl)-3-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | L558-0876 |
| Compound Name: | 1-methyl-7-(4-methylphenyl)-3-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 408.46 |
| Molecular Formula: | C21 H24 N6 O3 |
| Smiles: | Cc1ccc(cc1)c1ncc2C(N(CC(N3CCN(C)CC3)=O)C(N(C)c2n1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3599 |
| logD: | 1.2292 |
| logSw: | -2.0868 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 71.277 |
| InChI Key: | ABMRQMXPTQHQNE-UHFFFAOYSA-N |