N-(1,3-benzodioxol-5-yl)-4-bromobenzenesulfonamide
TL;DR: N-(1,3-benzodioxol-5-yl)-4-bromobenzenesulfonamide (CAS 353786-98-8) is a chemical compound with molecular formula C13H10BrNO4S and molecular weight 354.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzodioxol-5-yl)-4-bromobenzenesulfonamide
Also Known As: N-(1,3-benzodioxol-5-yl)-4-bromobenzenesulfonamide, N-BENZO[1,3]DIOXOL-5-YL-4-BROMO-BENZENESULFONAMIDE, N-(2H-1,3-BENZODIOXOL-5-YL)-4-BROMOBENZENESULFONAMIDE, 2h-benzo[3,4-d]1,3-dioxolan-5-yl[(4-bromophenyl)sulfonyl]amine, N~1~-(1,3-BENZODIOXOL-5-YL)-4-BROMO-1-BENZENESULFONAMIDE
| Molecular Formula | C13H10BrNO4S |
|---|---|
| Molecular Weight | 354.95 g/mol |
| LogP | 2.9786 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 354.9514 |
| Heavy Atoms | 20 |
| Complexity | 743.4665 |
Chemical Identifiers
| CAS Number | 353786-98-8 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)Br |
Product Overview
N-(1,3-benzodioxol-5-yl)-4-bromobenzenesulfonamide (CAS 353786-98-8), with molecular formula C13H10BrNO4S and molecular weight 354.95 g/mol. IUPAC: N-(1,3-benzodioxol-5-yl)-4-bromobenzenesulfonamide.
Chemical Property Profile of N-(1,3-benzodioxol-5-yl)-4-bromobenzenesulfonamide
Property Insights of N-(1,3-benzodioxol-5-yl)-4-bromobenzenesulfonamide
The XLogP value of 2.9786 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(1,3-benzodioxol-5-yl)-4-bromobenzenesulfonamide. The TPSA of 64.63 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1,3-benzodioxol-5-yl)-4-bromobenzenesulfonamide. Following Lipinski's Rule of Five, N-(1,3-benzodioxol-5-yl)-4-bromobenzenesulfonamide 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-(1,3-benzodioxol-5-yl)-4-bromobenzenesulfonamide?
The CAS number of N-(1,3-benzodioxol-5-yl)-4-bromobenzenesulfonamide is 353786-98-8.
What is the molecular formula of N-(1,3-benzodioxol-5-yl)-4-bromobenzenesulfonamide?
The molecular formula of N-(1,3-benzodioxol-5-yl)-4-bromobenzenesulfonamide is C13H10BrNO4S.
What is the molecular weight of N-(1,3-benzodioxol-5-yl)-4-bromobenzenesulfonamide?
The molecular weight of N-(1,3-benzodioxol-5-yl)-4-bromobenzenesulfonamide is 354.95 g/mol.
Where can I buy N-(1,3-benzodioxol-5-yl)-4-bromobenzenesulfonamide?
You can request a quote for N-(1,3-benzodioxol-5-yl)-4-bromobenzenesulfonamide 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-yl)-4-bromobenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,3-benzodioxol-5-yl)-4-bromobenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.