dimethyl 5-{[3-oxo-2-(pyridin-3-yl)-2,3-dihydro-1H-isoindol-1-yl]amino}benzene-1,3-dicarboxylate
Chemical Structure Depiction of
dimethyl 5-{[3-oxo-2-(pyridin-3-yl)-2,3-dihydro-1H-isoindol-1-yl]amino}benzene-1,3-dicarboxylate
dimethyl 5-{[3-oxo-2-(pyridin-3-yl)-2,3-dihydro-1H-isoindol-1-yl]amino}benzene-1,3-dicarboxylate
Compound characteristics
| Compound ID: | C430-0436 |
| Compound Name: | dimethyl 5-{[3-oxo-2-(pyridin-3-yl)-2,3-dihydro-1H-isoindol-1-yl]amino}benzene-1,3-dicarboxylate |
| Molecular Weight: | 417.42 |
| Molecular Formula: | C23 H19 N3 O5 |
| Smiles: | COC(c1cc(cc(c1)NC1c2ccccc2C(N1c1cccnc1)=O)C(=O)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5514 |
| logD: | 3.5514 |
| logSw: | -3.559 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.256 |
| InChI Key: | YOWQOKYIMHGLTE-HXUWFJFHSA-N |