4-{[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)imino]methyl}-2-nitrophenyl 4-methoxybenzoate
Chemical Structure Depiction of
4-{[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)imino]methyl}-2-nitrophenyl 4-methoxybenzoate
4-{[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)imino]methyl}-2-nitrophenyl 4-methoxybenzoate
Compound characteristics
| Compound ID: | 8003-4655 |
| Compound Name: | 4-{[(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)imino]methyl}-2-nitrophenyl 4-methoxybenzoate |
| Molecular Weight: | 445.39 |
| Molecular Formula: | C23 H15 N3 O7 |
| Smiles: | COc1ccc(cc1)C(=O)Oc1ccc(/C=N/N2C(c3ccccc3C2=O)=O)cc1[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.3091 |
| logD: | 3.3091 |
| logSw: | -3.9041 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 100.995 |
| InChI Key: | MQFZQAZEIRFPBC-UHFFFAOYSA-N |