N-{4,6-bis[4-(tert-butyl)phenoxy]-2-pyrimidinyl}-4-methoxybenzenesulfonamide structure

N-{4,6-bis[4-(tert-butyl)phenoxy]-2-pyrimidinyl}-4-methoxybenzenesulfonamide

TL;DR: N-{4,6-bis[4-(tert-butyl)phenoxy]-2-pyrimidinyl}-4-methoxybenzenesulfonamide (CAS 866154-37-2) is a chemical compound with molecular formula C31H35N3O5S and molecular weight 561.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.

N-[4,6-bis(4-tert-butylphenoxy)pyrimidin-2-yl]-4-methoxybenzenesulfonamide

Also Known As: N-{4,6-bis[4-(tert-butyl)phenoxy]-2-pyrimidinyl}-4-methoxybenzenesulfonamide, N-[4,6-bis(4-tert-butylphenoxy)pyrimidin-2-yl]-4-methoxybenzene-1-sulfonamide, N-[4,6-bis(4-tert-butylphenoxy)pyrimidin-2-yl]-4-methoxybenzenesulfonamide, N-[4,6-bis(4-tert-butylphenoxy)pyrimidin-2-yl]-4-methoxy-benzenesulfonamide

CAS: 866154-37-2
Molecular Formula C31H35N3O5S
Molecular Weight 561.23 g/mol
LogP 7.4656
Topological Polar Surface Area 99.64 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 7
Rotatable Bonds 8
Exact Mass 561.22974
Heavy Atoms 40
Complexity 1476.5432

Chemical Identifiers

CAS Number 866154-37-2
SMILES CC(C)(C)C1=CC=C(C=C1)OC2=CC(=NC(=N2)NS(=O)(=O)C3=CC=C(C=C3)OC)OC4=CC=C(C=C4)C(C)(C)C

Product Overview

N-{4,6-bis[4-(tert-butyl)phenoxy]-2-pyrimidinyl}-4-methoxybenzenesulfonamide (CAS 866154-37-2), with molecular formula C31H35N3O5S and molecular weight 561.23 g/mol. IUPAC: N-[4,6-bis(4-tert-butylphenoxy)pyrimidin-2-yl]-4-methoxybenzenesulfonamide.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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Chemical Property Profile of N-{4,6-bis[4-(tert-butyl)phenoxy]-2-pyrimidinyl}-4-methoxybenzenesulfonamide

XLogP
7.4656
TPSA (Topological Polar Surface Area)
99.64
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
7
Rotatable Bonds
8
Heavy Atoms
40
Complexity
1476.5432
Exact Mass
561.22974
Monoisotopic Mass
561.22974
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of N-{4,6-bis[4-(tert-butyl)phenoxy]-2-pyrimidinyl}-4-methoxybenzenesulfonamide

The XLogP value of 7.4656 indicates that N-{4,6-bis[4-(tert-butyl)phenoxy]-2-pyrimidinyl}-4-methoxybenzenesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.64 Ų falls within the moderate polarity range, balancing permeability and solubility for N-{4,6-bis[4-(tert-butyl)phenoxy]-2-pyrimidinyl}-4-methoxybenzenesulfonamide. Following Lipinski's Rule of Five, N-{4,6-bis[4-(tert-butyl)phenoxy]-2-pyrimidinyl}-4-methoxybenzenesulfonamide has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the typical lead time for this product?
Lead time typically ranges from 3-7 business days for in-stock items. For larger quantities or custom orders, please contact us for specific lead times.
Can you provide samples for testing?
Yes, we offer sample quantities for quality testing. Please submit an inquiry with your requirements and we will arrange samples accordingly.
What documentation do you provide with the product?
We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.
Do you ship internationally?
Yes, we ship to most countries worldwide. Shipping costs and delivery times vary by location. Please contact us for specific shipping information.

Frequently Asked Questions

What is the CAS number of N-{4,6-bis[4-(tert-butyl)phenoxy]-2-pyrimidinyl}-4-methoxybenzenesulfonamide?

The CAS number of N-{4,6-bis[4-(tert-butyl)phenoxy]-2-pyrimidinyl}-4-methoxybenzenesulfonamide is 866154-37-2.

What is the molecular formula of N-{4,6-bis[4-(tert-butyl)phenoxy]-2-pyrimidinyl}-4-methoxybenzenesulfonamide?

The molecular formula of N-{4,6-bis[4-(tert-butyl)phenoxy]-2-pyrimidinyl}-4-methoxybenzenesulfonamide is C31H35N3O5S.

What is the molecular weight of N-{4,6-bis[4-(tert-butyl)phenoxy]-2-pyrimidinyl}-4-methoxybenzenesulfonamide?

The molecular weight of N-{4,6-bis[4-(tert-butyl)phenoxy]-2-pyrimidinyl}-4-methoxybenzenesulfonamide is 561.23 g/mol.

Where can I buy N-{4,6-bis[4-(tert-butyl)phenoxy]-2-pyrimidinyl}-4-methoxybenzenesulfonamide?

You can request a quote for N-{4,6-bis[4-(tert-butyl)phenoxy]-2-pyrimidinyl}-4-methoxybenzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.

Does KEHONG BIO offer custom synthesis for N-{4,6-bis[4-(tert-butyl)phenoxy]-2-pyrimidinyl}-4-methoxybenzenesulfonamide?

Yes, KEHONG BIO provides custom synthesis services for N-{4,6-bis[4-(tert-butyl)phenoxy]-2-pyrimidinyl}-4-methoxybenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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