![benzenesulfonic acid; 3-[[4-[4-(4-carbamimidoylphenoxy)butoxy]phenyl]carbamoyl]benzenesulfonyl fluoride structure](/static/products/1816/18167-18-5.webp)
benzenesulfonic acid; 3-[[4-[4-(4-carbamimidoylphenoxy)butoxy]phenyl]carbamoyl]benzenesulfonyl fluoride
TL;DR: benzenesulfonic acid; 3-[[4-[4-(4-carbamimidoylphenoxy)butoxy]phenyl]carbamoyl]benzenesulfonyl fluoride (CAS 18167-18-5) is a chemical compound with molecular formula C30H30FN3O8S2 and molecular weight 643.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzenesulfonic acid;3-[[4-[4-(4-carbamimidoylphenoxy)butoxy]phenyl]carbamoyl]benzenesulfonyl fluoride
Also Known As: benzenesulfonic acid; 3-[[4-[4-(4-carbamimidoylphenoxy)butoxy]phenyl]carbamoyl]benzenesulfonyl fluoride, Benzenesulfonic acid--3-({4-[4-(4-carbamimidoylphenoxy)butoxy]phenyl}carbamoyl)benzene-1-sulfonyl fluoride (1/1)
| Molecular Formula | C30H30FN3O8S2 |
|---|---|
| Molecular Weight | 643.15 g/mol |
| LogP | 5.05247 |
| Topological Polar Surface Area | 203.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 12 |
| Exact Mass | 643.1458 |
| Heavy Atoms | 44 |
| Complexity | 943.0 |
Chemical Identifiers
| CAS Number | 18167-18-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)S(=O)(=O)O.C1=CC(=CC(=C1)S(=O)(=O)F)C(=O)NC2=CC=C(C=C2)OCCCCOC3=CC=C(C=C3)C(=N)N |
| InChIKey | CJQMSBBXWPLMAR-UHFFFAOYSA-N |
Product Overview
benzenesulfonic acid; 3-[[4-[4-(4-carbamimidoylphenoxy)butoxy]phenyl]carbamoyl]benzenesulfonyl fluoride (CAS 18167-18-5), with molecular formula C30H30FN3O8S2 and molecular weight 643.15 g/mol. IUPAC: benzenesulfonic acid;3-[[4-[4-(4-carbamimidoylphenoxy)butoxy]phenyl]carbamoyl]benzenesulfonyl fluoride.
Chemical Property Profile of benzenesulfonic acid; 3-[[4-[4-(4-carbamimidoylphenoxy)butoxy]phenyl]carbamoyl]benzenesulfonyl fluoride
Property Insights of benzenesulfonic acid; 3-[[4-[4-(4-carbamimidoylphenoxy)butoxy]phenyl]carbamoyl]benzenesulfonyl fluoride
The XLogP value of 5.05247 indicates that benzenesulfonic acid; 3-[[4-[4-(4-carbamimidoylphenoxy)butoxy]phenyl]carbamoyl]benzenesulfonyl fluoride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 203.0 Ų indicates high polarity, suggesting benzenesulfonic acid; 3-[[4-[4-(4-carbamimidoylphenoxy)butoxy]phenyl]carbamoyl]benzenesulfonyl fluoride may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, benzenesulfonic acid; 3-[[4-[4-(4-carbamimidoylphenoxy)butoxy]phenyl]carbamoyl]benzenesulfonyl fluoride has 4 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of benzenesulfonic acid; 3-[[4-[4-(4-carbamimidoylphenoxy)butoxy]phenyl]carbamoyl]benzenesulfonyl fluoride?
The CAS number of benzenesulfonic acid; 3-[[4-[4-(4-carbamimidoylphenoxy)butoxy]phenyl]carbamoyl]benzenesulfonyl fluoride is 18167-18-5.
What is the molecular formula of benzenesulfonic acid; 3-[[4-[4-(4-carbamimidoylphenoxy)butoxy]phenyl]carbamoyl]benzenesulfonyl fluoride?
The molecular formula of benzenesulfonic acid; 3-[[4-[4-(4-carbamimidoylphenoxy)butoxy]phenyl]carbamoyl]benzenesulfonyl fluoride is C30H30FN3O8S2.
What is the molecular weight of benzenesulfonic acid; 3-[[4-[4-(4-carbamimidoylphenoxy)butoxy]phenyl]carbamoyl]benzenesulfonyl fluoride?
The molecular weight of benzenesulfonic acid; 3-[[4-[4-(4-carbamimidoylphenoxy)butoxy]phenyl]carbamoyl]benzenesulfonyl fluoride is 643.15 g/mol.
Where can I buy benzenesulfonic acid; 3-[[4-[4-(4-carbamimidoylphenoxy)butoxy]phenyl]carbamoyl]benzenesulfonyl fluoride?
You can request a quote for benzenesulfonic acid; 3-[[4-[4-(4-carbamimidoylphenoxy)butoxy]phenyl]carbamoyl]benzenesulfonyl fluoride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for benzenesulfonic acid; 3-[[4-[4-(4-carbamimidoylphenoxy)butoxy]phenyl]carbamoyl]benzenesulfonyl fluoride?
Yes, KEHONG BIO provides custom synthesis services for benzenesulfonic acid; 3-[[4-[4-(4-carbamimidoylphenoxy)butoxy]phenyl]carbamoyl]benzenesulfonyl fluoride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.