1-methyl-3-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-7-phenylpyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
1-methyl-3-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-7-phenylpyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
1-methyl-3-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-7-phenylpyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | L558-1318 |
| Compound Name: | 1-methyl-3-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-7-phenylpyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 394.43 |
| Molecular Formula: | C20 H22 N6 O3 |
| Smiles: | CN1CCN(CC1)C(CN1C(c2cnc(c3ccccc3)nc2N(C)C1=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.8315 |
| logD: | 0.7008 |
| logSw: | -1.9088 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 71.277 |
| InChI Key: | YTPHJIYGOUUVPR-UHFFFAOYSA-N |