4-(2H-1,3-benzodioxol-5-yl)-7-(4-fluorophenyl)-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Chemical Structure Depiction of
4-(2H-1,3-benzodioxol-5-yl)-7-(4-fluorophenyl)-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
4-(2H-1,3-benzodioxol-5-yl)-7-(4-fluorophenyl)-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Compound characteristics
| Compound ID: | C276-1276 |
| Compound Name: | 4-(2H-1,3-benzodioxol-5-yl)-7-(4-fluorophenyl)-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione |
| Molecular Weight: | 379.39 |
| Molecular Formula: | C22 H18 F N O4 |
| Smiles: | C1C(CC(C2C(CC(NC1=2)=O)c1ccc2c(c1)OCO2)=O)c1ccc(cc1)F |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.585 |
| logD: | 2.3217 |
| logSw: | -3.6417 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.85 |
| InChI Key: | SXPOTTPDMWJTHD-UHFFFAOYSA-N |