3-{4-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]phenyl}-1-methylquinoxalin-2(1H)-one
Chemical Structure Depiction of
3-{4-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]phenyl}-1-methylquinoxalin-2(1H)-one
3-{4-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]phenyl}-1-methylquinoxalin-2(1H)-one
Compound characteristics
| Compound ID: | M049-0734 |
| Compound Name: | 3-{4-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]phenyl}-1-methylquinoxalin-2(1H)-one |
| Molecular Weight: | 452.56 |
| Molecular Formula: | C28 H28 N4 O2 |
| Smiles: | Cc1ccc(C)c(c1)N1CCN(CC1)C(c1ccc(cc1)C1C(N(C)c2ccccc2N=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.022 |
| logD: | 4.022 |
| logSw: | -4.0754 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.823 |
| InChI Key: | WLTKZGQIDQYAMX-UHFFFAOYSA-N |