5-Chlorosulfonyl-2-ethoxyphenyl urea
TL;DR: 5-Chlorosulfonyl-2-ethoxyphenyl urea (CAS 680185-46-0) is a chemical compound with molecular formula C9H11ClN2O4S and molecular weight 278.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(carbamoylamino)-4-ethoxybenzenesulfonyl chloride
Also Known As: 5-Chlorosulfonyl-2-ethoxyphenyl urea, 4-Ethoxy-3-ureidobenzene-1-sulfonyl chloride, 4-ethoxy-3-ureido-benzenesulfonyl chloride, 4-Ethoxy-3-ureidobenzene-1-sulfonylchloride, 3-(carbamoylamino)-4-ethoxybenzenesulfonyl chloride
| Molecular Formula | C9H11ClN2O4S |
|---|---|
| Molecular Weight | 278.01 g/mol |
| LogP | 1.5034 |
| Topological Polar Surface Area | 98.49 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 278.01282 |
| Heavy Atoms | 17 |
| Complexity | 529.7974 |
Chemical Identifiers
| CAS Number | 680185-46-0 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)S(=O)(=O)Cl)NC(=O)N |
Product Overview
5-Chlorosulfonyl-2-ethoxyphenyl urea (CAS 680185-46-0), with molecular formula C9H11ClN2O4S and molecular weight 278.01 g/mol. IUPAC: 3-(carbamoylamino)-4-ethoxybenzenesulfonyl chloride.
Chemical Property Profile of 5-Chlorosulfonyl-2-ethoxyphenyl urea
Property Insights of 5-Chlorosulfonyl-2-ethoxyphenyl urea
The XLogP value of 1.5034 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Chlorosulfonyl-2-ethoxyphenyl urea. The TPSA of 98.49 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Chlorosulfonyl-2-ethoxyphenyl urea. Following Lipinski's Rule of Five, 5-Chlorosulfonyl-2-ethoxyphenyl urea has 2 hydrogen bond donor(s) and 4 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 5-Chlorosulfonyl-2-ethoxyphenyl urea?
The CAS number of 5-Chlorosulfonyl-2-ethoxyphenyl urea is 680185-46-0.
What is the molecular formula of 5-Chlorosulfonyl-2-ethoxyphenyl urea?
The molecular formula of 5-Chlorosulfonyl-2-ethoxyphenyl urea is C9H11ClN2O4S.
What is the molecular weight of 5-Chlorosulfonyl-2-ethoxyphenyl urea?
The molecular weight of 5-Chlorosulfonyl-2-ethoxyphenyl urea is 278.01 g/mol.
Where can I buy 5-Chlorosulfonyl-2-ethoxyphenyl urea?
You can request a quote for 5-Chlorosulfonyl-2-ethoxyphenyl urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Chlorosulfonyl-2-ethoxyphenyl urea?
Yes, KEHONG BIO provides custom synthesis services for 5-Chlorosulfonyl-2-ethoxyphenyl urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.