1-ethyl-3-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-7-phenylpyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
1-ethyl-3-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-7-phenylpyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
1-ethyl-3-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-7-phenylpyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | L558-1097 |
| Compound Name: | 1-ethyl-3-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-7-phenylpyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 408.46 |
| Molecular Formula: | C21 H24 N6 O3 |
| Smiles: | CCN1C(N(CC(N2CCN(C)CC2)=O)C(c2cnc(c3ccccc3)nc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3933 |
| logD: | 1.2626 |
| logSw: | -2.1466 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 71.237 |
| InChI Key: | ONBFAJSIDQWOLH-UHFFFAOYSA-N |