N-(1,3-benzodioxol-5-ylmethyl)-4-chloro-2,5-dimethylbenzenesulfonamide
TL;DR: N-(1,3-benzodioxol-5-ylmethyl)-4-chloro-2,5-dimethylbenzenesulfonamide (CAS 791844-32-1) is a chemical compound with molecular formula C16H16ClNO4S and molecular weight 353.05 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-chloro-2,5-dimethylbenzenesulfonamide
Also Known As: UPCMLD0ENAT5972574:001, AP-263/43028236, N-(1,3-benzodioxol-5-ylmethyl)-4-chloro-2,5-dimethylbenzenesulfonamide, (2H-benzo[3,4-d]1,3-dioxolan-5-ylmethyl)[(4-chloro-2,5-dimethylphenyl)sulfonyl ]amine
| Molecular Formula | C16H16ClNO4S |
|---|---|
| Molecular Weight | 353.05 g/mol |
| LogP | 3.16404 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 353.04886 |
| Heavy Atoms | 23 |
| Complexity | 864.6242 |
Chemical Identifiers
| CAS Number | 791844-32-1 |
|---|---|
| SMILES | CC1=CC(=C(C=C1Cl)C)S(=O)(=O)NCC2=CC3=C(C=C2)OCO3 |
Product Overview
N-(1,3-benzodioxol-5-ylmethyl)-4-chloro-2,5-dimethylbenzenesulfonamide (CAS 791844-32-1), with molecular formula C16H16ClNO4S and molecular weight 353.05 g/mol. IUPAC: N-(1,3-benzodioxol-5-ylmethyl)-4-chloro-2,5-dimethylbenzenesulfonamide.
Chemical Property Profile of N-(1,3-benzodioxol-5-ylmethyl)-4-chloro-2,5-dimethylbenzenesulfonamide
Property Insights of N-(1,3-benzodioxol-5-ylmethyl)-4-chloro-2,5-dimethylbenzenesulfonamide
The XLogP value of 3.16404 indicates that N-(1,3-benzodioxol-5-ylmethyl)-4-chloro-2,5-dimethylbenzenesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.63 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1,3-benzodioxol-5-ylmethyl)-4-chloro-2,5-dimethylbenzenesulfonamide. Following Lipinski's Rule of Five, N-(1,3-benzodioxol-5-ylmethyl)-4-chloro-2,5-dimethylbenzenesulfonamide 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-ylmethyl)-4-chloro-2,5-dimethylbenzenesulfonamide?
The CAS number of N-(1,3-benzodioxol-5-ylmethyl)-4-chloro-2,5-dimethylbenzenesulfonamide is 791844-32-1.
What is the molecular formula of N-(1,3-benzodioxol-5-ylmethyl)-4-chloro-2,5-dimethylbenzenesulfonamide?
The molecular formula of N-(1,3-benzodioxol-5-ylmethyl)-4-chloro-2,5-dimethylbenzenesulfonamide is C16H16ClNO4S.
What is the molecular weight of N-(1,3-benzodioxol-5-ylmethyl)-4-chloro-2,5-dimethylbenzenesulfonamide?
The molecular weight of N-(1,3-benzodioxol-5-ylmethyl)-4-chloro-2,5-dimethylbenzenesulfonamide is 353.05 g/mol.
Where can I buy N-(1,3-benzodioxol-5-ylmethyl)-4-chloro-2,5-dimethylbenzenesulfonamide?
You can request a quote for N-(1,3-benzodioxol-5-ylmethyl)-4-chloro-2,5-dimethylbenzenesulfonamide 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-chloro-2,5-dimethylbenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,3-benzodioxol-5-ylmethyl)-4-chloro-2,5-dimethylbenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.