2-[2-(2H-1,3-benzodioxol-5-yl)-1-(4-bromophenyl)-4-oxoazetidin-3-yl]-4-nitro-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-[2-(2H-1,3-benzodioxol-5-yl)-1-(4-bromophenyl)-4-oxoazetidin-3-yl]-4-nitro-1H-isoindole-1,3(2H)-dione
2-[2-(2H-1,3-benzodioxol-5-yl)-1-(4-bromophenyl)-4-oxoazetidin-3-yl]-4-nitro-1H-isoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | 3009-4123 |
| Compound Name: | 2-[2-(2H-1,3-benzodioxol-5-yl)-1-(4-bromophenyl)-4-oxoazetidin-3-yl]-4-nitro-1H-isoindole-1,3(2H)-dione |
| Molecular Weight: | 536.29 |
| Molecular Formula: | C24 H14 Br N3 O7 |
| Smiles: | C1Oc2ccc(cc2O1)C1C(C(N1c1ccc(cc1)[Br])=O)N1C(c2cccc(c2C1=O)[N+]([O-])=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.3621 |
| logD: | 3.3621 |
| logSw: | -3.9583 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 93.051 |
| InChI Key: | OFCIUDOJPLEYFK-UHFFFAOYSA-N |