N-(1,3-Benzodioxol-5-ylmethyl)methanesulfonamide
TL;DR: N-(1,3-Benzodioxol-5-ylmethyl)methanesulfonamide (CAS 184041-99-4) is a chemical compound with molecular formula C9H11NO4S and molecular weight 229.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzodioxol-5-ylmethyl)methanesulfonamide
Also Known As: N-(1,3-Benzodioxol-5-ylmethyl)methanesulfonamide, N-(benzo[d][1,3]dioxol-5-ylmethyl)methanesulfonamide, n-(3,4-methylenedioxy)benzyl-methanesulfonamide, BAS 00435838, N-[(2H-1,3-benzodioxol-5-yl)methyl]methanesulfonamide
| Molecular Formula | C9H11NO4S |
|---|---|
| Molecular Weight | 229.04 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 73.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 229.04088 |
| Heavy Atoms | 15 |
| Complexity | 311.0 |
Chemical Identifiers
| CAS Number | 184041-99-4 |
|---|---|
| SMILES | CS(=O)(=O)NCC1=CC2=C(C=C1)OCO2 |
| InChIKey | JAOTTZZWODVWDG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-(1,3-Benzodioxol-5-ylmethyl)methanesulfonamide (CAS 184041-99-4), with molecular formula C9H11NO4S and molecular weight 229.04 g/mol. IUPAC: N-(1,3-benzodioxol-5-ylmethyl)methanesulfonamide.
Chemical Property Profile of N-(1,3-Benzodioxol-5-ylmethyl)methanesulfonamide
Property Insights of N-(1,3-Benzodioxol-5-ylmethyl)methanesulfonamide
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(1,3-Benzodioxol-5-ylmethyl)methanesulfonamide. The TPSA of 73.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1,3-Benzodioxol-5-ylmethyl)methanesulfonamide. Following Lipinski's Rule of Five, N-(1,3-Benzodioxol-5-ylmethyl)methanesulfonamide 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)methanesulfonamide?
The CAS number of N-(1,3-Benzodioxol-5-ylmethyl)methanesulfonamide is 184041-99-4.
What is the molecular formula of N-(1,3-Benzodioxol-5-ylmethyl)methanesulfonamide?
The molecular formula of N-(1,3-Benzodioxol-5-ylmethyl)methanesulfonamide is C9H11NO4S.
What is the molecular weight of N-(1,3-Benzodioxol-5-ylmethyl)methanesulfonamide?
The molecular weight of N-(1,3-Benzodioxol-5-ylmethyl)methanesulfonamide is 229.04 g/mol.
Where can I buy N-(1,3-Benzodioxol-5-ylmethyl)methanesulfonamide?
You can request a quote for N-(1,3-Benzodioxol-5-ylmethyl)methanesulfonamide 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)methanesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,3-Benzodioxol-5-ylmethyl)methanesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.