ethyl 3-(4-ethoxy-3-methoxyphenyl)-3-({3-oxo-2-[(pyridin-3-yl)methyl]-2,3-dihydro-1H-isoindole-4-carbonyl}amino)propanoate
Chemical Structure Depiction of
ethyl 3-(4-ethoxy-3-methoxyphenyl)-3-({3-oxo-2-[(pyridin-3-yl)methyl]-2,3-dihydro-1H-isoindole-4-carbonyl}amino)propanoate
ethyl 3-(4-ethoxy-3-methoxyphenyl)-3-({3-oxo-2-[(pyridin-3-yl)methyl]-2,3-dihydro-1H-isoindole-4-carbonyl}amino)propanoate
Compound characteristics
| Compound ID: | C447-0277 |
| Compound Name: | ethyl 3-(4-ethoxy-3-methoxyphenyl)-3-({3-oxo-2-[(pyridin-3-yl)methyl]-2,3-dihydro-1H-isoindole-4-carbonyl}amino)propanoate |
| Molecular Weight: | 517.58 |
| Molecular Formula: | C29 H31 N3 O6 |
| Smiles: | CCOC(CC(c1ccc(c(c1)OC)OCC)NC(c1cccc2CN(Cc3cccnc3)C(c12)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8721 |
| logD: | 2.8721 |
| logSw: | -3.203 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.446 |
| InChI Key: | XHUPLYDBEZRHMG-QHCPKHFHSA-N |