N-(1,3-benzodioxol-5-yl)-2-benzylsulfonylacetamide
TL;DR: N-(1,3-benzodioxol-5-yl)-2-benzylsulfonylacetamide (CAS 706769-89-3) is a chemical compound with molecular formula C16H15NO5S and molecular weight 333.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzodioxol-5-yl)-2-benzylsulfonylacetamide
Also Known As: BAS 07857106, N-(1,3-benzodioxol-5-yl)-2-benzylsulfonylacetamide, VU0307159-2, N-(1,3-benzodioxol-5-yl)-2-(benzylsulfonyl)acetamide, N-(2H-1,3-BENZODIOXOL-5-YL)-2-PHENYLMETHANESULFONYLACETAMIDE
| Molecular Formula | C16H15NO5S |
|---|---|
| Molecular Weight | 333.07 g/mol |
| LogP | 1.9688 |
| Topological Polar Surface Area | 81.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 333.0671 |
| Heavy Atoms | 23 |
| Complexity | 817.61914 |
Chemical Identifiers
| CAS Number | 706769-89-3 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)NC(=O)CS(=O)(=O)CC3=CC=CC=C3 |
Product Overview
N-(1,3-benzodioxol-5-yl)-2-benzylsulfonylacetamide (CAS 706769-89-3), with molecular formula C16H15NO5S and molecular weight 333.07 g/mol. IUPAC: N-(1,3-benzodioxol-5-yl)-2-benzylsulfonylacetamide.
Chemical Property Profile of N-(1,3-benzodioxol-5-yl)-2-benzylsulfonylacetamide
Property Insights of N-(1,3-benzodioxol-5-yl)-2-benzylsulfonylacetamide
The XLogP value of 1.9688 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(1,3-benzodioxol-5-yl)-2-benzylsulfonylacetamide. The TPSA of 81.7 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1,3-benzodioxol-5-yl)-2-benzylsulfonylacetamide. Following Lipinski's Rule of Five, N-(1,3-benzodioxol-5-yl)-2-benzylsulfonylacetamide 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-yl)-2-benzylsulfonylacetamide?
The CAS number of N-(1,3-benzodioxol-5-yl)-2-benzylsulfonylacetamide is 706769-89-3.
What is the molecular formula of N-(1,3-benzodioxol-5-yl)-2-benzylsulfonylacetamide?
The molecular formula of N-(1,3-benzodioxol-5-yl)-2-benzylsulfonylacetamide is C16H15NO5S.
What is the molecular weight of N-(1,3-benzodioxol-5-yl)-2-benzylsulfonylacetamide?
The molecular weight of N-(1,3-benzodioxol-5-yl)-2-benzylsulfonylacetamide is 333.07 g/mol.
Where can I buy N-(1,3-benzodioxol-5-yl)-2-benzylsulfonylacetamide?
You can request a quote for N-(1,3-benzodioxol-5-yl)-2-benzylsulfonylacetamide 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)-2-benzylsulfonylacetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,3-benzodioxol-5-yl)-2-benzylsulfonylacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.