N-(1,3-benzodioxol-5-ylmethyl)-2-thiophen-2-ylethenesulfonamide
TL;DR: N-(1,3-benzodioxol-5-ylmethyl)-2-thiophen-2-ylethenesulfonamide (CAS 339018-68-7) is a chemical compound with molecular formula C14H13NO4S2 and molecular weight 323.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzodioxol-5-ylmethyl)-2-thiophen-2-ylethenesulfonamide
Also Known As: (E)-N-(1,3-benzodioxol-5-ylmethyl)-2-(2-thienyl)-1-ethenesulfonamide, N-(1,3-benzodioxol-5-ylmethyl)-2-thiophen-2-ylethenesulfonamide
| Molecular Formula | C14H13NO4S2 |
|---|---|
| Molecular Weight | 323.03 g/mol |
| LogP | 2.5671 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 323.0286 |
| Heavy Atoms | 21 |
| Complexity | 751.28613 |
Chemical Identifiers
| CAS Number | 339018-68-7 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)CNS(=O)(=O)C=CC3=CC=CS3 |
Product Overview
N-(1,3-benzodioxol-5-ylmethyl)-2-thiophen-2-ylethenesulfonamide (CAS 339018-68-7), with molecular formula C14H13NO4S2 and molecular weight 323.03 g/mol. IUPAC: N-(1,3-benzodioxol-5-ylmethyl)-2-thiophen-2-ylethenesulfonamide.
Chemical Property Profile of N-(1,3-benzodioxol-5-ylmethyl)-2-thiophen-2-ylethenesulfonamide
Property Insights of N-(1,3-benzodioxol-5-ylmethyl)-2-thiophen-2-ylethenesulfonamide
The XLogP value of 2.5671 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(1,3-benzodioxol-5-ylmethyl)-2-thiophen-2-ylethenesulfonamide. The TPSA of 64.63 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1,3-benzodioxol-5-ylmethyl)-2-thiophen-2-ylethenesulfonamide. Following Lipinski's Rule of Five, N-(1,3-benzodioxol-5-ylmethyl)-2-thiophen-2-ylethenesulfonamide has 1 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 N-(1,3-benzodioxol-5-ylmethyl)-2-thiophen-2-ylethenesulfonamide?
The CAS number of N-(1,3-benzodioxol-5-ylmethyl)-2-thiophen-2-ylethenesulfonamide is 339018-68-7.
What is the molecular formula of N-(1,3-benzodioxol-5-ylmethyl)-2-thiophen-2-ylethenesulfonamide?
The molecular formula of N-(1,3-benzodioxol-5-ylmethyl)-2-thiophen-2-ylethenesulfonamide is C14H13NO4S2.
What is the molecular weight of N-(1,3-benzodioxol-5-ylmethyl)-2-thiophen-2-ylethenesulfonamide?
The molecular weight of N-(1,3-benzodioxol-5-ylmethyl)-2-thiophen-2-ylethenesulfonamide is 323.03 g/mol.
Where can I buy N-(1,3-benzodioxol-5-ylmethyl)-2-thiophen-2-ylethenesulfonamide?
You can request a quote for N-(1,3-benzodioxol-5-ylmethyl)-2-thiophen-2-ylethenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1,3-benzodioxol-5-ylmethyl)-2-thiophen-2-ylethenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,3-benzodioxol-5-ylmethyl)-2-thiophen-2-ylethenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.