![N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-chloro-5-nitrobenzene-1-sulfonamide structure](/static/products/3133/313395-41-4.webp)
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-chloro-5-nitrobenzene-1-sulfonamide
TL;DR: N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-chloro-5-nitrobenzene-1-sulfonamide (CAS 313395-41-4) is a chemical compound with molecular formula C14H11ClN2O6S and molecular weight 370.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzodioxol-5-ylmethyl)-2-chloro-5-nitrobenzenesulfonamide
Also Known As: UPCMLD0ENAT5974580:001, F0280-0022, N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-chloro-5-nitrobenzene-1-sulfonamide, A2440/0103410, N-(1,3-benzodioxol-5-ylmethyl)-2-chloro-5-nitrobenzenesulfonamide
| Molecular Formula | C14H11ClN2O6S |
|---|---|
| Molecular Weight | 370.00 g/mol |
| LogP | 2.4554 |
| Topological Polar Surface Area | 107.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 370.00262 |
| Heavy Atoms | 24 |
| Complexity | 915.4758 |
Chemical Identifiers
| CAS Number | 313395-41-4 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)CNS(=O)(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl |
Product Overview
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-chloro-5-nitrobenzene-1-sulfonamide (CAS 313395-41-4), with molecular formula C14H11ClN2O6S and molecular weight 370.00 g/mol. IUPAC: N-(1,3-benzodioxol-5-ylmethyl)-2-chloro-5-nitrobenzenesulfonamide.
Chemical Property Profile of N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-chloro-5-nitrobenzene-1-sulfonamide
Property Insights of N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-chloro-5-nitrobenzene-1-sulfonamide
The XLogP value of 2.4554 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-chloro-5-nitrobenzene-1-sulfonamide. The TPSA of 107.77 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-chloro-5-nitrobenzene-1-sulfonamide. Following Lipinski's Rule of Five, N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-chloro-5-nitrobenzene-1-sulfonamide has 1 hydrogen bond donor(s) and 6 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-[(2H-1,3-benzodioxol-5-yl)methyl]-2-chloro-5-nitrobenzene-1-sulfonamide?
The CAS number of N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-chloro-5-nitrobenzene-1-sulfonamide is 313395-41-4.
What is the molecular formula of N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-chloro-5-nitrobenzene-1-sulfonamide?
The molecular formula of N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-chloro-5-nitrobenzene-1-sulfonamide is C14H11ClN2O6S.
What is the molecular weight of N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-chloro-5-nitrobenzene-1-sulfonamide?
The molecular weight of N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-chloro-5-nitrobenzene-1-sulfonamide is 370.00 g/mol.
Where can I buy N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-chloro-5-nitrobenzene-1-sulfonamide?
You can request a quote for N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-chloro-5-nitrobenzene-1-sulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-chloro-5-nitrobenzene-1-sulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-chloro-5-nitrobenzene-1-sulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.