4-(2-{[1-oxo-2-(prop-2-en-1-yl)-1,2-dihydroisoquinolin-5-yl]oxy}acetamido)benzamide
Chemical Structure Depiction of
4-(2-{[1-oxo-2-(prop-2-en-1-yl)-1,2-dihydroisoquinolin-5-yl]oxy}acetamido)benzamide
4-(2-{[1-oxo-2-(prop-2-en-1-yl)-1,2-dihydroisoquinolin-5-yl]oxy}acetamido)benzamide
Compound characteristics
| Compound ID: | G856-9379 |
| Compound Name: | 4-(2-{[1-oxo-2-(prop-2-en-1-yl)-1,2-dihydroisoquinolin-5-yl]oxy}acetamido)benzamide |
| Molecular Weight: | 377.4 |
| Molecular Formula: | C21 H19 N3 O4 |
| Smiles: | C=CCN1C=Cc2c(cccc2OCC(Nc2ccc(cc2)C(N)=O)=O)C1=O |
| Stereo: | ACHIRAL |
| logP: | 1.5338 |
| logD: | 1.5335 |
| logSw: | -2.252 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 80.454 |
| InChI Key: | BMDLOAGQUBASKM-UHFFFAOYSA-N |