N-(3,4-dichlorophenyl)-2-{[1-oxo-2-(prop-2-en-1-yl)-1,2-dihydroisoquinolin-5-yl]oxy}acetamide
Chemical Structure Depiction of
N-(3,4-dichlorophenyl)-2-{[1-oxo-2-(prop-2-en-1-yl)-1,2-dihydroisoquinolin-5-yl]oxy}acetamide
N-(3,4-dichlorophenyl)-2-{[1-oxo-2-(prop-2-en-1-yl)-1,2-dihydroisoquinolin-5-yl]oxy}acetamide
Compound characteristics
| Compound ID: | G856-9384 |
| Compound Name: | N-(3,4-dichlorophenyl)-2-{[1-oxo-2-(prop-2-en-1-yl)-1,2-dihydroisoquinolin-5-yl]oxy}acetamide |
| Molecular Weight: | 403.26 |
| Molecular Formula: | C20 H16 Cl2 N2 O3 |
| Smiles: | C=CCN1C=Cc2c(cccc2OCC(Nc2ccc(c(c2)[Cl])[Cl])=O)C1=O |
| Stereo: | ACHIRAL |
| logP: | 4.3623 |
| logD: | 4.3533 |
| logSw: | -4.5886 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.395 |
| InChI Key: | NNMOXOYGKRHQOJ-UHFFFAOYSA-N |