N-(1,3-benzodioxol-5-ylmethyl)ethanesulfonamide
TL;DR: N-(1,3-benzodioxol-5-ylmethyl)ethanesulfonamide (CAS 332025-91-9) is a chemical compound with molecular formula C10H13NO4S and molecular weight 243.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzodioxol-5-ylmethyl)ethanesulfonamide
Also Known As: N-[(1,3-dioxaindan-5-yl)methyl]ethane-1-sulfonamide, N-(1,3-benzodioxol-5-ylmethyl)ethanesulfonamide, ~{N}-(1,3-benzodioxol-5-ylmethyl)ethanesulfonamide, (2H-benzo[3,4-d]1,3-dioxolan-5-ylmethyl)(ethylsulfonyl)amine, N-[(2H-13-BENZODIOXOL-5-YL)METHYL]ETHANE-1-SULFONAMIDE
| Molecular Formula | C10H13NO4S |
|---|---|
| Molecular Weight | 243.06 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 73.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 243.05653 |
| Heavy Atoms | 16 |
| Complexity | 324.0 |
Chemical Identifiers
| CAS Number | 332025-91-9 |
|---|---|
| SMILES | CCS(=O)(=O)NCC1=CC2=C(C=C1)OCO2 |
| InChIKey | UKPLBUIFSDRLEZ-UHFFFAOYSA-N |
Product Overview
N-(1,3-benzodioxol-5-ylmethyl)ethanesulfonamide (CAS 332025-91-9), with molecular formula C10H13NO4S and molecular weight 243.06 g/mol. IUPAC: N-(1,3-benzodioxol-5-ylmethyl)ethanesulfonamide.
Chemical Property Profile of N-(1,3-benzodioxol-5-ylmethyl)ethanesulfonamide
Property Insights of N-(1,3-benzodioxol-5-ylmethyl)ethanesulfonamide
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(1,3-benzodioxol-5-ylmethyl)ethanesulfonamide. The TPSA of 73.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1,3-benzodioxol-5-ylmethyl)ethanesulfonamide. Following Lipinski's Rule of Five, N-(1,3-benzodioxol-5-ylmethyl)ethanesulfonamide 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)ethanesulfonamide?
The CAS number of N-(1,3-benzodioxol-5-ylmethyl)ethanesulfonamide is 332025-91-9.
What is the molecular formula of N-(1,3-benzodioxol-5-ylmethyl)ethanesulfonamide?
The molecular formula of N-(1,3-benzodioxol-5-ylmethyl)ethanesulfonamide is C10H13NO4S.
What is the molecular weight of N-(1,3-benzodioxol-5-ylmethyl)ethanesulfonamide?
The molecular weight of N-(1,3-benzodioxol-5-ylmethyl)ethanesulfonamide is 243.06 g/mol.
Where can I buy N-(1,3-benzodioxol-5-ylmethyl)ethanesulfonamide?
You can request a quote for N-(1,3-benzodioxol-5-ylmethyl)ethanesulfonamide 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)ethanesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,3-benzodioxol-5-ylmethyl)ethanesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.