6-benzyl-8-(4-ethylbenzoyl)-2,3-dihydro[1,4]dioxino[2,3-g]quinolin-9(6H)-one
Chemical Structure Depiction of
6-benzyl-8-(4-ethylbenzoyl)-2,3-dihydro[1,4]dioxino[2,3-g]quinolin-9(6H)-one
6-benzyl-8-(4-ethylbenzoyl)-2,3-dihydro[1,4]dioxino[2,3-g]quinolin-9(6H)-one
Compound characteristics
| Compound ID: | C567-0028 |
| Compound Name: | 6-benzyl-8-(4-ethylbenzoyl)-2,3-dihydro[1,4]dioxino[2,3-g]quinolin-9(6H)-one |
| Molecular Weight: | 425.48 |
| Molecular Formula: | C27 H23 N O4 |
| Smiles: | CCc1ccc(cc1)C(C1=CN(Cc2ccccc2)c2cc3c(cc2C1=O)OCCO3)=O |
| Stereo: | ACHIRAL |
| logP: | 4.171 |
| logD: | 4.171 |
| logSw: | -4.245 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 44.853 |
| InChI Key: | IORNFZCVZKIBCE-UHFFFAOYSA-N |