1,1'-Sulfonylbis(4-butoxy-3-nitrobenzene)
TL;DR: 1,1'-Sulfonylbis(4-butoxy-3-nitrobenzene) (CAS 3704-32-3) is a chemical compound with molecular formula C20H24N2O8S and molecular weight 452.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-butoxy-4-(4-butoxy-3-nitrophenyl)sulfonyl-2-nitrobenzene
Also Known As: 1,1'-sulfonylbis(4-butoxy-3-nitrobenzene), 1-butoxy-4-(4-butoxy-3-nitrophenyl)sulfonyl-2-nitrobenzene, 1-butoxy-4-(4-butoxy-3-nitro-phenyl)sulfonyl-2-nitro-benzene
| Molecular Formula | C20H24N2O8S |
|---|---|
| Molecular Weight | 452.13 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 153.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 452.12534 |
| Heavy Atoms | 31 |
| Complexity | 633.0 |
Chemical Identifiers
| CAS Number | 3704-32-3 |
|---|---|
| SMILES | CCCCOC1=C(C=C(C=C1)S(=O)(=O)C2=CC(=C(C=C2)OCCCC)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | ZRSNQOMIUDVNOA-UHFFFAOYSA-N |
Product Overview
1,1'-Sulfonylbis(4-butoxy-3-nitrobenzene) (CAS 3704-32-3), with molecular formula C20H24N2O8S and molecular weight 452.13 g/mol. IUPAC: 1-butoxy-4-(4-butoxy-3-nitrophenyl)sulfonyl-2-nitrobenzene.
Chemical Property Profile of 1,1'-Sulfonylbis(4-butoxy-3-nitrobenzene)
Property Insights of 1,1'-Sulfonylbis(4-butoxy-3-nitrobenzene)
The XLogP value of 4.8 indicates that 1,1'-Sulfonylbis(4-butoxy-3-nitrobenzene) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 153.0 Ų indicates high polarity, suggesting 1,1'-Sulfonylbis(4-butoxy-3-nitrobenzene) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1,1'-Sulfonylbis(4-butoxy-3-nitrobenzene) has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,1'-Sulfonylbis(4-butoxy-3-nitrobenzene)?
The CAS number of 1,1'-Sulfonylbis(4-butoxy-3-nitrobenzene) is 3704-32-3.
What is the molecular formula of 1,1'-Sulfonylbis(4-butoxy-3-nitrobenzene)?
The molecular formula of 1,1'-Sulfonylbis(4-butoxy-3-nitrobenzene) is C20H24N2O8S.
What is the molecular weight of 1,1'-Sulfonylbis(4-butoxy-3-nitrobenzene)?
The molecular weight of 1,1'-Sulfonylbis(4-butoxy-3-nitrobenzene) is 452.13 g/mol.
Where can I buy 1,1'-Sulfonylbis(4-butoxy-3-nitrobenzene)?
You can request a quote for 1,1'-Sulfonylbis(4-butoxy-3-nitrobenzene) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1'-Sulfonylbis(4-butoxy-3-nitrobenzene)?
Yes, KEHONG BIO provides custom synthesis services for 1,1'-Sulfonylbis(4-butoxy-3-nitrobenzene) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.