1-{[4-(4-benzylpiperazine-1-carbonyl)phenyl]methyl}-3-methylquinoxalin-2(1H)-one
Chemical Structure Depiction of
1-{[4-(4-benzylpiperazine-1-carbonyl)phenyl]methyl}-3-methylquinoxalin-2(1H)-one
1-{[4-(4-benzylpiperazine-1-carbonyl)phenyl]methyl}-3-methylquinoxalin-2(1H)-one
Compound characteristics
| Compound ID: | F671-0078 |
| Compound Name: | 1-{[4-(4-benzylpiperazine-1-carbonyl)phenyl]methyl}-3-methylquinoxalin-2(1H)-one |
| Molecular Weight: | 452.56 |
| Molecular Formula: | C28 H28 N4 O2 |
| Smiles: | [H]c1cc2c(cc1[H])N(Cc1ccc(cc1)C(N1CCN(CC1)Cc1ccccc1)=O)C(C(C)=N2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2373 |
| logD: | 3.2219 |
| logSw: | -3.2811 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 42.812 |
| InChI Key: | VRUVAYCSGIUJOS-UHFFFAOYSA-N |