N-(1-benzyl-2,3-dihydro-1H-pyrrolo[2,3-b]quinolin-4-yl)-N~2~-[2-(3,4-dimethoxyphenyl)ethyl]-N~2~-methylglycinamide--oxalic acid (1/1)
Chemical Structure Depiction of
N-(1-benzyl-2,3-dihydro-1H-pyrrolo[2,3-b]quinolin-4-yl)-N~2~-[2-(3,4-dimethoxyphenyl)ethyl]-N~2~-methylglycinamide--oxalic acid (1/1)
N-(1-benzyl-2,3-dihydro-1H-pyrrolo[2,3-b]quinolin-4-yl)-N~2~-[2-(3,4-dimethoxyphenyl)ethyl]-N~2~-methylglycinamide--oxalic acid (1/1)
Compound characteristics
| Compound ID: | 8004-9099 |
| Compound Name: | N-(1-benzyl-2,3-dihydro-1H-pyrrolo[2,3-b]quinolin-4-yl)-N~2~-[2-(3,4-dimethoxyphenyl)ethyl]-N~2~-methylglycinamide--oxalic acid (1/1) |
| Molecular Weight: | 600.67 |
| Molecular Formula: | C31 H34 N4 O3 |
| Salt: | HOOCCOOH |
| Smiles: | CN(CCc1ccc(c(c1)OC)OC)CC(Nc1c2CCN(Cc3ccccc3)c2nc2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3139 |
| logD: | 2.8756 |
| logSw: | -4.346 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.618 |
| InChI Key: | XSYNINCFVITLDN-UHFFFAOYSA-N |