ethyl {3-[(3,4-dihydroisoquinolin-2(1H)-yl)(oxo)acetyl]-5-(4-fluoro-3-methylbenzamido)-1H-indol-1-yl}acetate
Chemical Structure Depiction of
ethyl {3-[(3,4-dihydroisoquinolin-2(1H)-yl)(oxo)acetyl]-5-(4-fluoro-3-methylbenzamido)-1H-indol-1-yl}acetate
ethyl {3-[(3,4-dihydroisoquinolin-2(1H)-yl)(oxo)acetyl]-5-(4-fluoro-3-methylbenzamido)-1H-indol-1-yl}acetate
Compound characteristics
| Compound ID: | V007-0494 |
| Compound Name: | ethyl {3-[(3,4-dihydroisoquinolin-2(1H)-yl)(oxo)acetyl]-5-(4-fluoro-3-methylbenzamido)-1H-indol-1-yl}acetate |
| Molecular Weight: | 541.58 |
| Molecular Formula: | C31 H28 F N3 O5 |
| Smiles: | CCOC(Cn1cc(C(C(N2CCc3ccccc3C2)=O)=O)c2cc(ccc12)NC(c1ccc(c(C)c1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7722 |
| logD: | 4.7696 |
| logSw: | -4.3089 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.541 |
| InChI Key: | HIIVOJHRQMIOHZ-UHFFFAOYSA-N |