ethyl {3-[(3,4-dihydroisoquinolin-2(1H)-yl)(oxo)acetyl]-5-(2-ethylbutanamido)-1H-indol-1-yl}acetate
Chemical Structure Depiction of
ethyl {3-[(3,4-dihydroisoquinolin-2(1H)-yl)(oxo)acetyl]-5-(2-ethylbutanamido)-1H-indol-1-yl}acetate
ethyl {3-[(3,4-dihydroisoquinolin-2(1H)-yl)(oxo)acetyl]-5-(2-ethylbutanamido)-1H-indol-1-yl}acetate
Compound characteristics
| Compound ID: | V006-1487 |
| Compound Name: | ethyl {3-[(3,4-dihydroisoquinolin-2(1H)-yl)(oxo)acetyl]-5-(2-ethylbutanamido)-1H-indol-1-yl}acetate |
| Molecular Weight: | 503.6 |
| Molecular Formula: | C29 H33 N3 O5 |
| Smiles: | CCC(CC)C(Nc1ccc2c(c1)c(cn2CC(=O)OCC)C(C(N1CCc2ccccc2C1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3043 |
| logD: | 4.3043 |
| logSw: | -3.9675 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.812 |
| InChI Key: | OJSHZUOEHPZELU-UHFFFAOYSA-N |