TL;DR: 1,3-Dibromo-5-(3,5-dibromo-4-phenylmethoxyphenyl)sulfonyl-2-phenylmethoxybenzene (CAS 122438-81-7) is a chemical compound with molecular formula C26H18Br4O4S and molecular weight 741.7659 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,3-dibromo-5-(3,5-dibromo-4-phenylmethoxyphenyl)sulfonyl-2-phenylmethoxybenzene
Also Known As: 5,5'-sulfonylbis(2-(benzyloxy)-1,3-dibromobenzene), F0701-0116, 2-(BENZYLOXY)-5-[4-(BENZYLOXY)-3,5-DIBROMOBENZENESULFONYL]-1,3-DIBROMOBENZENE, di-4-(benzyloxy)-3,5-dibromophenyl(oxo)-lambda-sulfaniumolate, 1,3-dibromo-5-(3,5-dibromo-4-phenylmethoxyphenyl)sulfonyl-2-phenylmethoxybenzene
| Molecular Formula | C26H18Br4O4S |
| Molecular Weight | 741.7659 g/mol |
| XLogP | 8.4 |
| Topological Polar Surface Area (TPSA) | 61.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 741.7659 Da |
| Heavy Atoms | 35 |
| Complexity | 671.0 |
| SMILES | C1=CC=C(C=C1)COC2=C(C=C(C=C2Br)S(=O)(=O)C3=CC(=C(C(=C3)Br)OCC4=CC=CC=C4)Br)Br |
| InChIKey | GTLVRRLJNFWITH-UHFFFAOYSA-N |
The XLogP value of 8.4 indicates that 1,3-Dibromo-5-(3,5-dibromo-4-phenylmethoxyphenyl)sulfonyl-2-phenylmethoxybenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-Dibromo-5-(3,5-dibromo-4-phenylmethoxyphenyl)sulfonyl-2-phenylmethoxybenzene. Following Lipinski's Rule of Five, 1,3-Dibromo-5-(3,5-dibromo-4-phenylmethoxyphenyl)sulfonyl-2-phenylmethoxybenzene has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 1,3-Dibromo-5-(3,5-dibromo-4-phenylmethoxyphenyl)sulfonyl-2-phenylmethoxybenzene is 122438-81-7.
The molecular formula of 1,3-Dibromo-5-(3,5-dibromo-4-phenylmethoxyphenyl)sulfonyl-2-phenylmethoxybenzene is C26H18Br4O4S.
The molecular weight of 1,3-Dibromo-5-(3,5-dibromo-4-phenylmethoxyphenyl)sulfonyl-2-phenylmethoxybenzene is 741.7659 g/mol.
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