methyl 2-[6-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)hexanamido]benzoate
Chemical Structure Depiction of
methyl 2-[6-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)hexanamido]benzoate
methyl 2-[6-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)hexanamido]benzoate
Compound characteristics
| Compound ID: | 1682-3588 |
| Compound Name: | methyl 2-[6-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)hexanamido]benzoate |
| Molecular Weight: | 394.43 |
| Molecular Formula: | C22 H22 N2 O5 |
| Smiles: | COC(c1ccccc1NC(CCCCCN1C(c2ccccc2C1=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7469 |
| logD: | 2.7213 |
| logSw: | -3.3046 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.095 |
| InChI Key: | MILHBOBAEIUKBE-UHFFFAOYSA-N |