2-[1-(4-bromophenyl)-2-(2,5-dimethoxyphenyl)-4-oxoazetidin-3-yl]-5-nitro-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-[1-(4-bromophenyl)-2-(2,5-dimethoxyphenyl)-4-oxoazetidin-3-yl]-5-nitro-1H-isoindole-1,3(2H)-dione
2-[1-(4-bromophenyl)-2-(2,5-dimethoxyphenyl)-4-oxoazetidin-3-yl]-5-nitro-1H-isoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | 3091-4704 |
| Compound Name: | 2-[1-(4-bromophenyl)-2-(2,5-dimethoxyphenyl)-4-oxoazetidin-3-yl]-5-nitro-1H-isoindole-1,3(2H)-dione |
| Molecular Weight: | 552.34 |
| Molecular Formula: | C25 H18 Br N3 O7 |
| Smiles: | COc1ccc(c(c1)C1C(C(N1c1ccc(cc1)[Br])=O)N1C(c2ccc(cc2C1=O)[N+]([O-])=O)=O)OC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.7633 |
| logD: | 4.7633 |
| logSw: | -4.7784 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 91.411 |
| InChI Key: | ZMDLCGMRUMXOOP-UHFFFAOYSA-N |