4-(tert-butyl)-N-(5-(3-methoxyphenoxy)-6-(4-oxobutoxy)pyrimidin-4-yl)benzenesulfonamide
TL;DR: 4-(tert-butyl)-N-(5-(3-methoxyphenoxy)-6-(4-oxobutoxy)pyrimidin-4-yl)benzenesulfonamide (CAS 202287-80-7) is a chemical compound with molecular formula C25H29N3O6S and molecular weight 499.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-tert-butyl-N-[5-(3-methoxyphenoxy)-6-(4-oxobutoxy)pyrimidin-4-yl]benzenesulfonamide
Also Known As: 4-(tert-butyl)-N-(5-(3-methoxyphenoxy)-6-(4-oxobutoxy)pyrimidin-4-yl)benzenesulfonamide, N-[5-(3-methoxyphenoxy)-6-(4-oxobutoxy)pyrimidin-4-yl]-4-tert-butyl-benzenesulfonamide
| Molecular Formula | C25H29N3O6S |
|---|---|
| Molecular Weight | 499.18 g/mol |
| LogP | 4.7337 |
| Topological Polar Surface Area | 116.71 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 11 |
| Exact Mass | 499.1777 |
| Heavy Atoms | 35 |
| Complexity | 1254.939 |
Chemical Identifiers
| CAS Number | 202287-80-7 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=C(C(=NC=N2)OCCCC=O)OC3=CC=CC(=C3)OC |
Product Overview
4-(tert-butyl)-N-(5-(3-methoxyphenoxy)-6-(4-oxobutoxy)pyrimidin-4-yl)benzenesulfonamide (CAS 202287-80-7), with molecular formula C25H29N3O6S and molecular weight 499.18 g/mol. IUPAC: 4-tert-butyl-N-[5-(3-methoxyphenoxy)-6-(4-oxobutoxy)pyrimidin-4-yl]benzenesulfonamide.
Chemical Property Profile of 4-(tert-butyl)-N-(5-(3-methoxyphenoxy)-6-(4-oxobutoxy)pyrimidin-4-yl)benzenesulfonamide
Property Insights of 4-(tert-butyl)-N-(5-(3-methoxyphenoxy)-6-(4-oxobutoxy)pyrimidin-4-yl)benzenesulfonamide
The XLogP value of 4.7337 indicates that 4-(tert-butyl)-N-(5-(3-methoxyphenoxy)-6-(4-oxobutoxy)pyrimidin-4-yl)benzenesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 116.71 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(tert-butyl)-N-(5-(3-methoxyphenoxy)-6-(4-oxobutoxy)pyrimidin-4-yl)benzenesulfonamide. Following Lipinski's Rule of Five, 4-(tert-butyl)-N-(5-(3-methoxyphenoxy)-6-(4-oxobutoxy)pyrimidin-4-yl)benzenesulfonamide has 1 hydrogen bond donor(s) and 8 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 4-(tert-butyl)-N-(5-(3-methoxyphenoxy)-6-(4-oxobutoxy)pyrimidin-4-yl)benzenesulfonamide?
The CAS number of 4-(tert-butyl)-N-(5-(3-methoxyphenoxy)-6-(4-oxobutoxy)pyrimidin-4-yl)benzenesulfonamide is 202287-80-7.
What is the molecular formula of 4-(tert-butyl)-N-(5-(3-methoxyphenoxy)-6-(4-oxobutoxy)pyrimidin-4-yl)benzenesulfonamide?
The molecular formula of 4-(tert-butyl)-N-(5-(3-methoxyphenoxy)-6-(4-oxobutoxy)pyrimidin-4-yl)benzenesulfonamide is C25H29N3O6S.
What is the molecular weight of 4-(tert-butyl)-N-(5-(3-methoxyphenoxy)-6-(4-oxobutoxy)pyrimidin-4-yl)benzenesulfonamide?
The molecular weight of 4-(tert-butyl)-N-(5-(3-methoxyphenoxy)-6-(4-oxobutoxy)pyrimidin-4-yl)benzenesulfonamide is 499.18 g/mol.
Where can I buy 4-(tert-butyl)-N-(5-(3-methoxyphenoxy)-6-(4-oxobutoxy)pyrimidin-4-yl)benzenesulfonamide?
You can request a quote for 4-(tert-butyl)-N-(5-(3-methoxyphenoxy)-6-(4-oxobutoxy)pyrimidin-4-yl)benzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(tert-butyl)-N-(5-(3-methoxyphenoxy)-6-(4-oxobutoxy)pyrimidin-4-yl)benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 4-(tert-butyl)-N-(5-(3-methoxyphenoxy)-6-(4-oxobutoxy)pyrimidin-4-yl)benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.