2-[1-(4-bromo-3-methylphenyl)-2-oxo-4-(thiophen-2-yl)azetidin-3-yl]-5-nitro-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-[1-(4-bromo-3-methylphenyl)-2-oxo-4-(thiophen-2-yl)azetidin-3-yl]-5-nitro-1H-isoindole-1,3(2H)-dione
2-[1-(4-bromo-3-methylphenyl)-2-oxo-4-(thiophen-2-yl)azetidin-3-yl]-5-nitro-1H-isoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | 3061-4415 |
| Compound Name: | 2-[1-(4-bromo-3-methylphenyl)-2-oxo-4-(thiophen-2-yl)azetidin-3-yl]-5-nitro-1H-isoindole-1,3(2H)-dione |
| Molecular Weight: | 512.34 |
| Molecular Formula: | C22 H14 Br N3 O5 S |
| Smiles: | Cc1cc(ccc1[Br])N1C(C(C1=O)N1C(c2ccc(cc2C1=O)[N+]([O-])=O)=O)c1cccs1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.7041 |
| logD: | 4.7041 |
| logSw: | -4.6909 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 77.255 |
| InChI Key: | GCWNBXCJMFEZMA-UHFFFAOYSA-N |