3-{2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}-1-ethyl-7-phenylpyrimido[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-ethyl-7-phenylpyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
3-{2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}-1-ethyl-7-phenylpyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | L558-1169 |
| Compound Name: | 3-{2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-oxoethyl}-1-ethyl-7-phenylpyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 498.58 |
| Molecular Formula: | C28 H30 N6 O3 |
| Smiles: | CCN1C(N(CC(N2CCN(CC2)c2cccc(C)c2C)=O)C(c2cnc(c3ccccc3)nc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3341 |
| logD: | 4.334 |
| logSw: | -4.2433 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 70.719 |
| InChI Key: | OPYHXOZXTYCIPG-UHFFFAOYSA-N |