2-{[(5-methylpyridin-2-yl)amino]methyl}-4-nitro-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-{[(5-methylpyridin-2-yl)amino]methyl}-4-nitro-1H-isoindole-1,3(2H)-dione
2-{[(5-methylpyridin-2-yl)amino]methyl}-4-nitro-1H-isoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | 2314-0193 |
| Compound Name: | 2-{[(5-methylpyridin-2-yl)amino]methyl}-4-nitro-1H-isoindole-1,3(2H)-dione |
| Molecular Weight: | 312.28 |
| Molecular Formula: | C15 H12 N4 O4 |
| Smiles: | Cc1ccc(NCN2C(c3cccc(c3C2=O)[N+]([O-])=O)=O)nc1 |
| Stereo: | ACHIRAL |
| logP: | 1.6971 |
| logD: | 1.6971 |
| logSw: | -2.2809 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.436 |
| InChI Key: | NXBAJCUADWGBNB-UHFFFAOYSA-N |