7-(2H-1,3-benzodioxole-5-carbonyl)-5-[(4-fluorophenyl)methyl]-2H-[1,3]dioxolo[4,5-g]quinolin-8(5H)-one
Chemical Structure Depiction of
7-(2H-1,3-benzodioxole-5-carbonyl)-5-[(4-fluorophenyl)methyl]-2H-[1,3]dioxolo[4,5-g]quinolin-8(5H)-one
7-(2H-1,3-benzodioxole-5-carbonyl)-5-[(4-fluorophenyl)methyl]-2H-[1,3]dioxolo[4,5-g]quinolin-8(5H)-one
Compound characteristics
| Compound ID: | C567-0587 |
| Compound Name: | 7-(2H-1,3-benzodioxole-5-carbonyl)-5-[(4-fluorophenyl)methyl]-2H-[1,3]dioxolo[4,5-g]quinolin-8(5H)-one |
| Molecular Weight: | 445.4 |
| Molecular Formula: | C25 H16 F N O6 |
| Smiles: | C(c1ccc(cc1)F)N1C=C(C(c2ccc3c(c2)OCO3)=O)C(c2cc3c(cc12)OCO3)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3191 |
| logD: | 4.3191 |
| logSw: | -4.4791 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 63.26 |
| InChI Key: | HRWRJHPIAOCSEF-UHFFFAOYSA-N |