methyl 4-[5-(4-nitrophenoxy)-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl]benzoate
Chemical Structure Depiction of
methyl 4-[5-(4-nitrophenoxy)-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl]benzoate
methyl 4-[5-(4-nitrophenoxy)-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl]benzoate
Compound characteristics
| Compound ID: | 2922-0784 |
| Compound Name: | methyl 4-[5-(4-nitrophenoxy)-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl]benzoate |
| Molecular Weight: | 418.36 |
| Molecular Formula: | C22 H14 N2 O7 |
| Smiles: | COC(c1ccc(cc1)N1C(c2ccc(cc2C1=O)Oc1ccc(cc1)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5511 |
| logD: | 4.5511 |
| logSw: | -4.547 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 90.183 |
| InChI Key: | VPZHLYJFOPXCAS-UHFFFAOYSA-N |