N-(3-benzothiazol-2-ylsulfanyl-4-hydroxy-naphthalen-1-yl)-4-methoxy-3-nitro-benzenesulfonamide
TL;DR: N-(3-benzothiazol-2-ylsulfanyl-4-hydroxy-naphthalen-1-yl)-4-methoxy-3-nitro-benzenesulfonamide (CAS 6214-76-2) is a chemical compound with molecular formula C24H17N3O6S3 and molecular weight 539.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-(1,3-benzothiazol-2-ylsulfanyl)-4-hydroxynaphthalen-1-yl]-4-methoxy-3-nitrobenzenesulfonamide
Also Known As: N-(3-benzothiazol-2-ylsulfanyl-4-hydroxy-naphthalen-1-yl)-4-methoxy-3-nitro-benzenesulfonamide, N-[3-(1,3-benzothiazol-2-ylsulfanyl)-4-hydroxynaphthalen-1-yl]-4-methoxy-3-nitrobenzenesulfonamide, N-[3-(1,3-BENZOTHIAZOL-2-YLSULFANYL)-4-HYDROXYNAPHTHALEN-1-YL]-4-METHOXY-3-NITROBENZENE-1-SULFONAMIDE, N-{3-[(1,3-Benzothiazol-2-yl)sulfanyl]-4-hydroxynaphthalen-1-yl}-4-methoxy-3-nitrobenzene-1-sulfonamide
| Molecular Formula | C24H17N3O6S3 |
|---|---|
| Molecular Weight | 539.03 g/mol |
| LogP | 6.0239 |
| Topological Polar Surface Area | 131.66 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 7 |
| Exact Mass | 539.02795 |
| Heavy Atoms | 36 |
| Complexity | 1718.4734 |
Chemical Identifiers
| CAS Number | 6214-76-2 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)S(=O)(=O)NC2=CC(=C(C3=CC=CC=C32)O)SC4=NC5=CC=CC=C5S4)[N+](=O)[O-] |
Product Overview
N-(3-benzothiazol-2-ylsulfanyl-4-hydroxy-naphthalen-1-yl)-4-methoxy-3-nitro-benzenesulfonamide (CAS 6214-76-2), with molecular formula C24H17N3O6S3 and molecular weight 539.03 g/mol. IUPAC: N-[3-(1,3-benzothiazol-2-ylsulfanyl)-4-hydroxynaphthalen-1-yl]-4-methoxy-3-nitrobenzenesulfonamide.
Chemical Property Profile of N-(3-benzothiazol-2-ylsulfanyl-4-hydroxy-naphthalen-1-yl)-4-methoxy-3-nitro-benzenesulfonamide
Property Insights of N-(3-benzothiazol-2-ylsulfanyl-4-hydroxy-naphthalen-1-yl)-4-methoxy-3-nitro-benzenesulfonamide
The XLogP value of 6.0239 indicates that N-(3-benzothiazol-2-ylsulfanyl-4-hydroxy-naphthalen-1-yl)-4-methoxy-3-nitro-benzenesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 131.66 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-benzothiazol-2-ylsulfanyl-4-hydroxy-naphthalen-1-yl)-4-methoxy-3-nitro-benzenesulfonamide. Following Lipinski's Rule of Five, N-(3-benzothiazol-2-ylsulfanyl-4-hydroxy-naphthalen-1-yl)-4-methoxy-3-nitro-benzenesulfonamide has 2 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-(3-benzothiazol-2-ylsulfanyl-4-hydroxy-naphthalen-1-yl)-4-methoxy-3-nitro-benzenesulfonamide?
The CAS number of N-(3-benzothiazol-2-ylsulfanyl-4-hydroxy-naphthalen-1-yl)-4-methoxy-3-nitro-benzenesulfonamide is 6214-76-2.
What is the molecular formula of N-(3-benzothiazol-2-ylsulfanyl-4-hydroxy-naphthalen-1-yl)-4-methoxy-3-nitro-benzenesulfonamide?
The molecular formula of N-(3-benzothiazol-2-ylsulfanyl-4-hydroxy-naphthalen-1-yl)-4-methoxy-3-nitro-benzenesulfonamide is C24H17N3O6S3.
What is the molecular weight of N-(3-benzothiazol-2-ylsulfanyl-4-hydroxy-naphthalen-1-yl)-4-methoxy-3-nitro-benzenesulfonamide?
The molecular weight of N-(3-benzothiazol-2-ylsulfanyl-4-hydroxy-naphthalen-1-yl)-4-methoxy-3-nitro-benzenesulfonamide is 539.03 g/mol.
Where can I buy N-(3-benzothiazol-2-ylsulfanyl-4-hydroxy-naphthalen-1-yl)-4-methoxy-3-nitro-benzenesulfonamide?
You can request a quote for N-(3-benzothiazol-2-ylsulfanyl-4-hydroxy-naphthalen-1-yl)-4-methoxy-3-nitro-benzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-benzothiazol-2-ylsulfanyl-4-hydroxy-naphthalen-1-yl)-4-methoxy-3-nitro-benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3-benzothiazol-2-ylsulfanyl-4-hydroxy-naphthalen-1-yl)-4-methoxy-3-nitro-benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.