N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[3-(3,4-dimethylbenzoyl)-6-fluoro-4-oxoquinolin-1(4H)-yl]acetamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[3-(3,4-dimethylbenzoyl)-6-fluoro-4-oxoquinolin-1(4H)-yl]acetamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[3-(3,4-dimethylbenzoyl)-6-fluoro-4-oxoquinolin-1(4H)-yl]acetamide
Compound characteristics
| Compound ID: | C647-0004 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[3-(3,4-dimethylbenzoyl)-6-fluoro-4-oxoquinolin-1(4H)-yl]acetamide |
| Molecular Weight: | 486.5 |
| Molecular Formula: | C28 H23 F N2 O5 |
| Smiles: | Cc1ccc(cc1C)C(C1=CN(CC(Nc2ccc3c(c2)OCCO3)=O)c2ccc(cc2C1=O)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0623 |
| logD: | 4.0622 |
| logSw: | -4.2687 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.002 |
| InChI Key: | CJRTVZMRGCSTBN-UHFFFAOYSA-N |