methyl 2-{[2-(2-methoxyethyl)-3-oxo-2,3-dihydro-1H-isoindole-4-carbonyl]amino}benzoate
Chemical Structure Depiction of
methyl 2-{[2-(2-methoxyethyl)-3-oxo-2,3-dihydro-1H-isoindole-4-carbonyl]amino}benzoate
methyl 2-{[2-(2-methoxyethyl)-3-oxo-2,3-dihydro-1H-isoindole-4-carbonyl]amino}benzoate
Compound characteristics
| Compound ID: | C447-0826 |
| Compound Name: | methyl 2-{[2-(2-methoxyethyl)-3-oxo-2,3-dihydro-1H-isoindole-4-carbonyl]amino}benzoate |
| Molecular Weight: | 368.39 |
| Molecular Formula: | C20 H20 N2 O5 |
| Smiles: | COCCN1Cc2cccc(C(Nc3ccccc3C(=O)OC)=O)c2C1=O |
| Stereo: | ACHIRAL |
| logP: | 2.2061 |
| logD: | 1.8195 |
| logSw: | -3.0076 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.045 |
| InChI Key: | BECSCMXVYFORIB-UHFFFAOYSA-N |