![1-[(5-chloro-2-ethoxyphenyl)sulfonyl]-1H-1,2,3-benzotriazole structure](/static/products/7008/700853-53-8.webp)
1-[(5-chloro-2-ethoxyphenyl)sulfonyl]-1H-1,2,3-benzotriazole
TL;DR: 1-[(5-chloro-2-ethoxyphenyl)sulfonyl]-1H-1,2,3-benzotriazole (CAS 700853-53-8) is a chemical compound with molecular formula C14H12ClN3O3S and molecular weight 337.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(5-chloro-2-ethoxyphenyl)sulfonylbenzotriazole
Also Known As: CBKinase1_005396, CBKinase1_017796, 1-[(5-chloro-2-ethoxyphenyl)sulfonyl]-1H-1,2,3-benzotriazole, 1-(5-chloro-2-ethoxyphenyl)sulfonylbenzotriazole, 1-(5-chloro-2-ethoxy-phenyl)sulfonylbenzotriazole
| Molecular Formula | C14H12ClN3O3S |
|---|---|
| Molecular Weight | 337.03 g/mol |
| LogP | 2.7204 |
| Topological Polar Surface Area | 74.08 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 337.02878 |
| Heavy Atoms | 22 |
| Complexity | 937.411 |
Chemical Identifiers
| CAS Number | 700853-53-8 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)Cl)S(=O)(=O)N2C3=CC=CC=C3N=N2 |
Product Overview
1-[(5-chloro-2-ethoxyphenyl)sulfonyl]-1H-1,2,3-benzotriazole (CAS 700853-53-8), with molecular formula C14H12ClN3O3S and molecular weight 337.03 g/mol. IUPAC: 1-(5-chloro-2-ethoxyphenyl)sulfonylbenzotriazole.
Chemical Property Profile of 1-[(5-chloro-2-ethoxyphenyl)sulfonyl]-1H-1,2,3-benzotriazole
Property Insights of 1-[(5-chloro-2-ethoxyphenyl)sulfonyl]-1H-1,2,3-benzotriazole
The XLogP value of 2.7204 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[(5-chloro-2-ethoxyphenyl)sulfonyl]-1H-1,2,3-benzotriazole. The TPSA of 74.08 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[(5-chloro-2-ethoxyphenyl)sulfonyl]-1H-1,2,3-benzotriazole. Following Lipinski's Rule of Five, 1-[(5-chloro-2-ethoxyphenyl)sulfonyl]-1H-1,2,3-benzotriazole has 0 hydrogen bond donor(s) and 5 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-[(5-chloro-2-ethoxyphenyl)sulfonyl]-1H-1,2,3-benzotriazole?
The CAS number of 1-[(5-chloro-2-ethoxyphenyl)sulfonyl]-1H-1,2,3-benzotriazole is 700853-53-8.
What is the molecular formula of 1-[(5-chloro-2-ethoxyphenyl)sulfonyl]-1H-1,2,3-benzotriazole?
The molecular formula of 1-[(5-chloro-2-ethoxyphenyl)sulfonyl]-1H-1,2,3-benzotriazole is C14H12ClN3O3S.
What is the molecular weight of 1-[(5-chloro-2-ethoxyphenyl)sulfonyl]-1H-1,2,3-benzotriazole?
The molecular weight of 1-[(5-chloro-2-ethoxyphenyl)sulfonyl]-1H-1,2,3-benzotriazole is 337.03 g/mol.
Where can I buy 1-[(5-chloro-2-ethoxyphenyl)sulfonyl]-1H-1,2,3-benzotriazole?
You can request a quote for 1-[(5-chloro-2-ethoxyphenyl)sulfonyl]-1H-1,2,3-benzotriazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(5-chloro-2-ethoxyphenyl)sulfonyl]-1H-1,2,3-benzotriazole?
Yes, KEHONG BIO provides custom synthesis services for 1-[(5-chloro-2-ethoxyphenyl)sulfonyl]-1H-1,2,3-benzotriazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.