N-[2-(1H-indol-3-yl)ethyl]-2-(3-methoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
N-[2-(1H-indol-3-yl)ethyl]-2-(3-methoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
N-[2-(1H-indol-3-yl)ethyl]-2-(3-methoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | E456-2294 |
| Compound Name: | N-[2-(1H-indol-3-yl)ethyl]-2-(3-methoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide |
| Molecular Weight: | 437.5 |
| Molecular Formula: | C27 H23 N3 O3 |
| Smiles: | COc1cccc(c1)N1C=C(C(NCCc2c[nH]c3ccccc23)=O)c2ccccc2C1=O |
| Stereo: | ACHIRAL |
| logP: | 3.5753 |
| logD: | 3.5753 |
| logSw: | -3.8317 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.424 |
| InChI Key: | YTFNITYVRLLEAY-UHFFFAOYSA-N |