![1-[(3,4-Dimethoxyphenyl)sulfonyl]azepane structure](/static/products/3337/333745-32-7.webp)
1-[(3,4-Dimethoxyphenyl)sulfonyl]azepane
TL;DR: 1-[(3,4-Dimethoxyphenyl)sulfonyl]azepane (CAS 333745-32-7) is a chemical compound with molecular formula C14H21NO4S and molecular weight 299.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3,4-dimethoxyphenyl)sulfonylazepane
Also Known As: 1-[(3,4-dimethoxyphenyl)sulfonyl]azepane, 1-(3,4-dimethoxyphenyl)sulfonylazepane, [(3,4-dimethoxyphenyl)sulfonyl]azaperhydroepine, AS-871/15277070
| Molecular Formula | C14H21NO4S |
|---|---|
| Molecular Weight | 299.12 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 64.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 299.11914 |
| Heavy Atoms | 20 |
| Complexity | 384.0 |
Chemical Identifiers
| CAS Number | 333745-32-7 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)OC |
| InChIKey | LDVFQUUGKAPIRI-UHFFFAOYSA-N |
Product Overview
1-[(3,4-Dimethoxyphenyl)sulfonyl]azepane (CAS 333745-32-7), with molecular formula C14H21NO4S and molecular weight 299.12 g/mol. IUPAC: 1-(3,4-dimethoxyphenyl)sulfonylazepane.
Chemical Property Profile of 1-[(3,4-Dimethoxyphenyl)sulfonyl]azepane
Property Insights of 1-[(3,4-Dimethoxyphenyl)sulfonyl]azepane
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[(3,4-Dimethoxyphenyl)sulfonyl]azepane. The TPSA of 64.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[(3,4-Dimethoxyphenyl)sulfonyl]azepane. Following Lipinski's Rule of Five, 1-[(3,4-Dimethoxyphenyl)sulfonyl]azepane 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-[(3,4-Dimethoxyphenyl)sulfonyl]azepane?
The CAS number of 1-[(3,4-Dimethoxyphenyl)sulfonyl]azepane is 333745-32-7.
What is the molecular formula of 1-[(3,4-Dimethoxyphenyl)sulfonyl]azepane?
The molecular formula of 1-[(3,4-Dimethoxyphenyl)sulfonyl]azepane is C14H21NO4S.
What is the molecular weight of 1-[(3,4-Dimethoxyphenyl)sulfonyl]azepane?
The molecular weight of 1-[(3,4-Dimethoxyphenyl)sulfonyl]azepane is 299.12 g/mol.
Where can I buy 1-[(3,4-Dimethoxyphenyl)sulfonyl]azepane?
You can request a quote for 1-[(3,4-Dimethoxyphenyl)sulfonyl]azepane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(3,4-Dimethoxyphenyl)sulfonyl]azepane?
Yes, KEHONG BIO provides custom synthesis services for 1-[(3,4-Dimethoxyphenyl)sulfonyl]azepane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.