5-benzyl-7-(4-ethylbenzoyl)-2H-[1,3]dioxolo[4,5-g]quinolin-8(5H)-one
Chemical Structure Depiction of
5-benzyl-7-(4-ethylbenzoyl)-2H-[1,3]dioxolo[4,5-g]quinolin-8(5H)-one
5-benzyl-7-(4-ethylbenzoyl)-2H-[1,3]dioxolo[4,5-g]quinolin-8(5H)-one
Compound characteristics
| Compound ID: | C567-0027 |
| Compound Name: | 5-benzyl-7-(4-ethylbenzoyl)-2H-[1,3]dioxolo[4,5-g]quinolin-8(5H)-one |
| Molecular Weight: | 411.46 |
| Molecular Formula: | C26 H21 N O4 |
| Smiles: | CCc1ccc(cc1)C(C1=CN(Cc2ccccc2)c2cc3c(cc2C1=O)OCO3)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2458 |
| logD: | 5.2458 |
| logSw: | -5.0705 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.145 |
| InChI Key: | QIIHTNXBGCDRKH-UHFFFAOYSA-N |