5-{4-[2-(3,4-dimethylphenyl)quinoline-4-carbonyl]piperazin-1-yl}-1,3,6-trimethylpyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
5-{4-[2-(3,4-dimethylphenyl)quinoline-4-carbonyl]piperazin-1-yl}-1,3,6-trimethylpyrimidine-2,4(1H,3H)-dione
5-{4-[2-(3,4-dimethylphenyl)quinoline-4-carbonyl]piperazin-1-yl}-1,3,6-trimethylpyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | F667-0191 |
| Compound Name: | 5-{4-[2-(3,4-dimethylphenyl)quinoline-4-carbonyl]piperazin-1-yl}-1,3,6-trimethylpyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 497.6 |
| Molecular Formula: | C29 H31 N5 O3 |
| Smiles: | CC1=C(C(N(C)C(N1C)=O)=O)N1CCN(CC1)C(c1cc(c2ccc(C)c(C)c2)nc2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8714 |
| logD: | 4.8688 |
| logSw: | -4.7368 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 59.728 |
| InChI Key: | OMGDNYITSBKRQZ-UHFFFAOYSA-N |