[5-(morpholin-4-yl)-6-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl]acetic acid
Chemical Structure Depiction of
[5-(morpholin-4-yl)-6-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl]acetic acid
[5-(morpholin-4-yl)-6-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl]acetic acid
Compound characteristics
| Compound ID: | 5274-2061 |
| Compound Name: | [5-(morpholin-4-yl)-6-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl]acetic acid |
| Molecular Weight: | 335.27 |
| Molecular Formula: | C14 H13 N3 O7 |
| Smiles: | C1COCCN1c1cc2C(N(CC(O)=O)C(c2cc1[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | -0.4723 |
| logD: | -4.899 |
| logSw: | -1.5748 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 102.287 |
| InChI Key: | YMDBWIJENJSOCX-UHFFFAOYSA-N |