3-(2H-1,3-benzodioxole-5-carbonyl)-1-[(3-fluorophenyl)methyl]-6-methylquinolin-4(1H)-one
Chemical Structure Depiction of
3-(2H-1,3-benzodioxole-5-carbonyl)-1-[(3-fluorophenyl)methyl]-6-methylquinolin-4(1H)-one
3-(2H-1,3-benzodioxole-5-carbonyl)-1-[(3-fluorophenyl)methyl]-6-methylquinolin-4(1H)-one
Compound characteristics
| Compound ID: | C567-0382 |
| Compound Name: | 3-(2H-1,3-benzodioxole-5-carbonyl)-1-[(3-fluorophenyl)methyl]-6-methylquinolin-4(1H)-one |
| Molecular Weight: | 415.42 |
| Molecular Formula: | C25 H18 F N O4 |
| Smiles: | Cc1ccc2c(c1)C(C(=CN2Cc1cccc(c1)F)C(c1ccc2c(c1)OCO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5663 |
| logD: | 4.5663 |
| logSw: | -4.4975 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.145 |
| InChI Key: | ASOCOXKYAHFXPK-UHFFFAOYSA-N |