propyl 3-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-6,7-dimethylquinoxaline-2-carboxylate
Chemical Structure Depiction of
propyl 3-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-6,7-dimethylquinoxaline-2-carboxylate
propyl 3-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-6,7-dimethylquinoxaline-2-carboxylate
Compound characteristics
| Compound ID: | F218-1870 |
| Compound Name: | propyl 3-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-6,7-dimethylquinoxaline-2-carboxylate |
| Molecular Weight: | 462.55 |
| Molecular Formula: | C26 H30 N4 O4 |
| Smiles: | CCCOC(c1c(nc2cc(C)c(C)cc2n1)N1CCN(CC1)Cc1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4181 |
| logD: | 4.5606 |
| logSw: | -5.4098 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 63.031 |
| InChI Key: | XVBWGFAGFZCKAN-UHFFFAOYSA-N |