4-(2H-1,3-benzodioxol-5-yl)-7-(3,4-dimethoxyphenyl)-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Chemical Structure Depiction of
4-(2H-1,3-benzodioxol-5-yl)-7-(3,4-dimethoxyphenyl)-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
4-(2H-1,3-benzodioxol-5-yl)-7-(3,4-dimethoxyphenyl)-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Compound characteristics
| Compound ID: | C276-1257 |
| Compound Name: | 4-(2H-1,3-benzodioxol-5-yl)-7-(3,4-dimethoxyphenyl)-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione |
| Molecular Weight: | 421.45 |
| Molecular Formula: | C24 H23 N O6 |
| Smiles: | COc1ccc(cc1OC)C1CC2=C(C(CC(N2)=O)c2ccc3c(c2)OCO3)C(C1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.0524 |
| logD: | 1.7891 |
| logSw: | -3.211 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.111 |
| InChI Key: | PTUSYTRQFXPLCY-UHFFFAOYSA-N |