4-nitro-2-(9H-xanthen-9-yl)-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
4-nitro-2-(9H-xanthen-9-yl)-1H-isoindole-1,3(2H)-dione
4-nitro-2-(9H-xanthen-9-yl)-1H-isoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | 5274-0246 |
| Compound Name: | 4-nitro-2-(9H-xanthen-9-yl)-1H-isoindole-1,3(2H)-dione |
| Molecular Weight: | 372.34 |
| Molecular Formula: | C21 H12 N2 O5 |
| Smiles: | c1ccc2c(c1)C(c1ccccc1O2)N1C(c2cccc(c2C1=O)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.378 |
| logD: | 3.3778 |
| logSw: | -4.1836 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.346 |
| InChI Key: | WPXYVCSUJHULNH-UHFFFAOYSA-N |