N-(2,4-dimethoxyphenyl)-2-[7-(4-fluorobenzoyl)-8-oxo-2H-[1,3]dioxolo[4,5-g]quinolin-5(8H)-yl]acetamide
Chemical Structure Depiction of
N-(2,4-dimethoxyphenyl)-2-[7-(4-fluorobenzoyl)-8-oxo-2H-[1,3]dioxolo[4,5-g]quinolin-5(8H)-yl]acetamide
N-(2,4-dimethoxyphenyl)-2-[7-(4-fluorobenzoyl)-8-oxo-2H-[1,3]dioxolo[4,5-g]quinolin-5(8H)-yl]acetamide
Compound characteristics
| Compound ID: | C647-0351 |
| Compound Name: | N-(2,4-dimethoxyphenyl)-2-[7-(4-fluorobenzoyl)-8-oxo-2H-[1,3]dioxolo[4,5-g]quinolin-5(8H)-yl]acetamide |
| Molecular Weight: | 504.47 |
| Molecular Formula: | C27 H21 F N2 O7 |
| Smiles: | COc1ccc(c(c1)OC)NC(CN1C=C(C(c2ccc(cc2)F)=O)C(c2cc3c(cc12)OCO3)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8526 |
| logD: | 3.8524 |
| logSw: | -4.1536 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.771 |
| InChI Key: | JHTBFXUAAYCNOA-UHFFFAOYSA-N |