2-[2-(5-bromo-2-methoxyphenyl)-1-(4-methoxyphenyl)-4-oxoazetidin-3-yl]-5-nitro-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-[2-(5-bromo-2-methoxyphenyl)-1-(4-methoxyphenyl)-4-oxoazetidin-3-yl]-5-nitro-1H-isoindole-1,3(2H)-dione
2-[2-(5-bromo-2-methoxyphenyl)-1-(4-methoxyphenyl)-4-oxoazetidin-3-yl]-5-nitro-1H-isoindole-1,3(2H)-dione
Compound characteristics
Compound ID: | 3061-4370 |
Compound Name: | 2-[2-(5-bromo-2-methoxyphenyl)-1-(4-methoxyphenyl)-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(cc1)N1C(C(C1=O)N1C(c2ccc(cc2C1=O)[N+]([O-])=O)=O)c1cc(ccc1OC)[Br] |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 4.6466 |
logD: | 4.6466 |
logSw: | -4.7053 |
Hydrogen bond acceptors count: | 12 |
Polar surface area: | 91.411 |
InChI Key: | PNNSFPUSPXGWFT-UHFFFAOYSA-N |