methyl 1-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-1H-indole-3-carboxylate
Chemical Structure Depiction of
methyl 1-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-1H-indole-3-carboxylate
methyl 1-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-1H-indole-3-carboxylate
Compound characteristics
| Compound ID: | 6637-1252 |
| Compound Name: | methyl 1-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-1H-indole-3-carboxylate |
| Molecular Weight: | 348.4 |
| Molecular Formula: | C21 H20 N2 O3 |
| Smiles: | COC(c1cn(CC(N2CCc3ccccc3C2)=O)c2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2295 |
| logD: | 3.2295 |
| logSw: | -3.1833 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 39.199 |
| InChI Key: | FUKDNXCNUZZFAD-UHFFFAOYSA-N |