ethyl 3-{[2-(2-methoxyethyl)-3-oxo-2,3-dihydro-1H-isoindole-4-carbonyl]amino}benzoate
Chemical Structure Depiction of
ethyl 3-{[2-(2-methoxyethyl)-3-oxo-2,3-dihydro-1H-isoindole-4-carbonyl]amino}benzoate
ethyl 3-{[2-(2-methoxyethyl)-3-oxo-2,3-dihydro-1H-isoindole-4-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | C447-0814 |
| Compound Name: | ethyl 3-{[2-(2-methoxyethyl)-3-oxo-2,3-dihydro-1H-isoindole-4-carbonyl]amino}benzoate |
| Molecular Weight: | 382.41 |
| Molecular Formula: | C21 H22 N2 O5 |
| Smiles: | CCOC(c1cccc(c1)NC(c1cccc2CN(CCOC)C(c12)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0653 |
| logD: | 3.065 |
| logSw: | -3.5211 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.322 |
| InChI Key: | QBWSOBRXKMGOKA-UHFFFAOYSA-N |