![N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-methylbenzenesulfonamide structure](/static/products/6488/64880-90-6.webp)
N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-methylbenzenesulfonamide
TL;DR: N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-methylbenzenesulfonamide (CAS 64880-90-6) is a chemical compound with molecular formula C16H17NO4S and molecular weight 319.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-methylbenzenesulfonamide
Also Known As: N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-methylbenzenesulfonamide, N-[2-(2H-1,3-benzodioxol-5-yl)ethyl]-4-methylbenzene-1-sulfonamide, AN-970/40920815, J1.645.058H, N-Toluolsulfonyl-3,4-methylendioxy-phenethylamin
| Molecular Formula | C16H17NO4S |
|---|---|
| Molecular Weight | 319.09 g/mol |
| LogP | 2.24472 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 319.08783 |
| Heavy Atoms | 22 |
| Complexity | 769.23285 |
Chemical Identifiers
| CAS Number | 64880-90-6 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)NCCC2=CC3=C(C=C2)OCO3 |
Product Overview
N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-methylbenzenesulfonamide (CAS 64880-90-6), with molecular formula C16H17NO4S and molecular weight 319.09 g/mol. IUPAC: N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-methylbenzenesulfonamide.
Chemical Property Profile of N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-methylbenzenesulfonamide
Property Insights of N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-methylbenzenesulfonamide
The XLogP value of 2.24472 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-methylbenzenesulfonamide. The TPSA of 64.63 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-methylbenzenesulfonamide. Following Lipinski's Rule of Five, N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-methylbenzenesulfonamide has 1 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 N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-methylbenzenesulfonamide?
The CAS number of N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-methylbenzenesulfonamide is 64880-90-6.
What is the molecular formula of N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-methylbenzenesulfonamide?
The molecular formula of N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-methylbenzenesulfonamide is C16H17NO4S.
What is the molecular weight of N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-methylbenzenesulfonamide?
The molecular weight of N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-methylbenzenesulfonamide is 319.09 g/mol.
Where can I buy N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-methylbenzenesulfonamide?
You can request a quote for N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-methylbenzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-methylbenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-[2-(1,3-benzodioxol-5-yl)ethyl]-4-methylbenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.