![4-[2-(1,3-Benzodioxol-5-ylmethylamino)ethyl]benzenesulfonamide structure](/static/products/875/875002-04-3.png)
4-[2-(1,3-Benzodioxol-5-ylmethylamino)ethyl]benzenesulfonamide
TL;DR: 4-[2-(1,3-Benzodioxol-5-ylmethylamino)ethyl]benzenesulfonamide (CAS 875002-04-3) is a chemical compound with molecular formula C16H18N2O4S and molecular weight 334.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-(1,3-benzodioxol-5-ylmethylamino)ethyl]benzenesulfonamide
Also Known As: BAS 12422556, 4-[2-(1,3-benzodioxol-5-ylmethylamino)ethyl]benzenesulfonamide, 4-{2-[(1,3-benzodioxol-5-ylmethyl)amino]ethyl}benzenesulfonamide, 4-{2-[(Benzo[1,3]dioxol-5-ylmethyl)-amino]-ethyl}-benzenesulfonamide
| Molecular Formula | C16H18N2O4S |
|---|---|
| Molecular Weight | 334.10 g/mol |
| LogP | 1.395 |
| Topological Polar Surface Area | 90.65 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 334.09872 |
| Heavy Atoms | 23 |
| Complexity | 788.2276 |
Chemical Identifiers
| CAS Number | 875002-04-3 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)CNCCC3=CC=C(C=C3)S(=O)(=O)N |
Product Overview
4-[2-(1,3-Benzodioxol-5-ylmethylamino)ethyl]benzenesulfonamide (CAS 875002-04-3), with molecular formula C16H18N2O4S and molecular weight 334.10 g/mol. IUPAC: 4-[2-(1,3-benzodioxol-5-ylmethylamino)ethyl]benzenesulfonamide.
Chemical Property Profile of 4-[2-(1,3-Benzodioxol-5-ylmethylamino)ethyl]benzenesulfonamide
Property Insights of 4-[2-(1,3-Benzodioxol-5-ylmethylamino)ethyl]benzenesulfonamide
The XLogP value of 1.395 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[2-(1,3-Benzodioxol-5-ylmethylamino)ethyl]benzenesulfonamide. The TPSA of 90.65 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[2-(1,3-Benzodioxol-5-ylmethylamino)ethyl]benzenesulfonamide. Following Lipinski's Rule of Five, 4-[2-(1,3-Benzodioxol-5-ylmethylamino)ethyl]benzenesulfonamide has 2 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 4-[2-(1,3-Benzodioxol-5-ylmethylamino)ethyl]benzenesulfonamide?
The CAS number of 4-[2-(1,3-Benzodioxol-5-ylmethylamino)ethyl]benzenesulfonamide is 875002-04-3.
What is the molecular formula of 4-[2-(1,3-Benzodioxol-5-ylmethylamino)ethyl]benzenesulfonamide?
The molecular formula of 4-[2-(1,3-Benzodioxol-5-ylmethylamino)ethyl]benzenesulfonamide is C16H18N2O4S.
What is the molecular weight of 4-[2-(1,3-Benzodioxol-5-ylmethylamino)ethyl]benzenesulfonamide?
The molecular weight of 4-[2-(1,3-Benzodioxol-5-ylmethylamino)ethyl]benzenesulfonamide is 334.10 g/mol.
Where can I buy 4-[2-(1,3-Benzodioxol-5-ylmethylamino)ethyl]benzenesulfonamide?
You can request a quote for 4-[2-(1,3-Benzodioxol-5-ylmethylamino)ethyl]benzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[2-(1,3-Benzodioxol-5-ylmethylamino)ethyl]benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 4-[2-(1,3-Benzodioxol-5-ylmethylamino)ethyl]benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.