N-(1,3-benzodioxol-5-ylmethyl)-4-bromo-2,5-dimethoxybenzenesulfonamide
TL;DR: N-(1,3-benzodioxol-5-ylmethyl)-4-bromo-2,5-dimethoxybenzenesulfonamide (CAS 433694-62-3) is a chemical compound with molecular formula C16H16BrNO6S and molecular weight 428.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzodioxol-5-ylmethyl)-4-bromo-2,5-dimethoxybenzenesulfonamide
Also Known As: N-(1,3-benzodioxol-5-ylmethyl)-4-bromo-2,5-dimethoxybenzenesulfonamide, N-(benzo[1,3]dioxol-5-ylmethyl)-4-bromo-2,5-dimethoxy-benzenesulfonamide, (2H-benzo[3,4-d]1,3-dioxolan-5-ylmethyl)[(4-bromo-2,5-dimethoxyphenyl)sulfonyl ]amine, N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-bromo-2,5-dimethoxybenzene-1-sulfonamide, Cambridge id 6970120
| Molecular Formula | C16H16BrNO6S |
|---|---|
| Molecular Weight | 428.99 g/mol |
| LogP | 2.6735 |
| Topological Polar Surface Area | 83.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 428.98816 |
| Heavy Atoms | 25 |
| Complexity | 899.7382 |
Chemical Identifiers
| CAS Number | 433694-62-3 |
|---|---|
| SMILES | COC1=CC(=C(C=C1Br)OC)S(=O)(=O)NCC2=CC3=C(C=C2)OCO3 |
Product Overview
N-(1,3-benzodioxol-5-ylmethyl)-4-bromo-2,5-dimethoxybenzenesulfonamide (CAS 433694-62-3), with molecular formula C16H16BrNO6S and molecular weight 428.99 g/mol. IUPAC: N-(1,3-benzodioxol-5-ylmethyl)-4-bromo-2,5-dimethoxybenzenesulfonamide.
Chemical Property Profile of N-(1,3-benzodioxol-5-ylmethyl)-4-bromo-2,5-dimethoxybenzenesulfonamide
Property Insights of N-(1,3-benzodioxol-5-ylmethyl)-4-bromo-2,5-dimethoxybenzenesulfonamide
The XLogP value of 2.6735 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(1,3-benzodioxol-5-ylmethyl)-4-bromo-2,5-dimethoxybenzenesulfonamide. The TPSA of 83.09 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1,3-benzodioxol-5-ylmethyl)-4-bromo-2,5-dimethoxybenzenesulfonamide. Following Lipinski's Rule of Five, N-(1,3-benzodioxol-5-ylmethyl)-4-bromo-2,5-dimethoxybenzenesulfonamide has 1 hydrogen bond donor(s) and 6 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)-4-bromo-2,5-dimethoxybenzenesulfonamide?
The CAS number of N-(1,3-benzodioxol-5-ylmethyl)-4-bromo-2,5-dimethoxybenzenesulfonamide is 433694-62-3.
What is the molecular formula of N-(1,3-benzodioxol-5-ylmethyl)-4-bromo-2,5-dimethoxybenzenesulfonamide?
The molecular formula of N-(1,3-benzodioxol-5-ylmethyl)-4-bromo-2,5-dimethoxybenzenesulfonamide is C16H16BrNO6S.
What is the molecular weight of N-(1,3-benzodioxol-5-ylmethyl)-4-bromo-2,5-dimethoxybenzenesulfonamide?
The molecular weight of N-(1,3-benzodioxol-5-ylmethyl)-4-bromo-2,5-dimethoxybenzenesulfonamide is 428.99 g/mol.
Where can I buy N-(1,3-benzodioxol-5-ylmethyl)-4-bromo-2,5-dimethoxybenzenesulfonamide?
You can request a quote for N-(1,3-benzodioxol-5-ylmethyl)-4-bromo-2,5-dimethoxybenzenesulfonamide 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)-4-bromo-2,5-dimethoxybenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,3-benzodioxol-5-ylmethyl)-4-bromo-2,5-dimethoxybenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.