2-(4-methylphenyl)-2-oxoethyl N-[(4-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetyl]glycinate
Chemical Structure Depiction of
2-(4-methylphenyl)-2-oxoethyl N-[(4-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetyl]glycinate
2-(4-methylphenyl)-2-oxoethyl N-[(4-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetyl]glycinate
Compound characteristics
| Compound ID: | Y511-8606 |
| Compound Name: | 2-(4-methylphenyl)-2-oxoethyl N-[(4-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetyl]glycinate |
| Molecular Weight: | 439.38 |
| Molecular Formula: | C21 H17 N3 O8 |
| Smiles: | Cc1ccc(cc1)C(COC(CNC(CN1C(c2cccc(c2C1=O)[N+]([O-])=O)=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.8775 |
| logD: | 0.8775 |
| logSw: | -2.586 |
| Hydrogen bond acceptors count: | 15 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 120.8 |
| InChI Key: | UHDITEBAWQZDOA-UHFFFAOYSA-N |