![1-Tert-butyl-3-[2-(2-chlorophenyl)sulfanylpyridin-3-yl]sulfonylurea structure](/static/products/848/84881-83-4.png)
1-Tert-butyl-3-[2-(2-chlorophenyl)sulfanylpyridin-3-yl]sulfonylurea
TL;DR: 1-Tert-butyl-3-[2-(2-chlorophenyl)sulfanylpyridin-3-yl]sulfonylurea (CAS 84881-83-4) is a chemical compound with molecular formula C16H18ClN3O3S2 and molecular weight 399.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-tert-butyl-3-[[2-(2-chlorophenyl)sulfanyl-3-pyridinyl]sulfonyl]urea
Also Known As: 1-tert-butyl-3-[2-(2-chlorophenyl)sulfanylpyridin-3-yl]sulfonylurea, 1-tert-butyl-3-[2-(2-chlorophenyl)sulfanylpyridin-3-yl]sulfo, N-(tert-Butylcarbamoyl)-2-[(2-chlorophenyl)sulfanyl]pyridine-3-sulfonamide
| Molecular Formula | C16H18ClN3O3S2 |
|---|---|
| Molecular Weight | 399.05 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 122.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 399.04782 |
| Heavy Atoms | 25 |
| Complexity | 560.0 |
Chemical Identifiers
| CAS Number | 84881-83-4 |
|---|---|
| SMILES | CC(C)(C)NC(=O)NS(=O)(=O)C1=C(N=CC=C1)SC2=CC=CC=C2Cl |
| InChIKey | FQJBSEFHFHGMKJ-UHFFFAOYSA-N |
Product Overview
1-Tert-butyl-3-[2-(2-chlorophenyl)sulfanylpyridin-3-yl]sulfonylurea (CAS 84881-83-4), with molecular formula C16H18ClN3O3S2 and molecular weight 399.05 g/mol. IUPAC: 1-tert-butyl-3-[[2-(2-chlorophenyl)sulfanyl-3-pyridinyl]sulfonyl]urea.
Chemical Property Profile of 1-Tert-butyl-3-[2-(2-chlorophenyl)sulfanylpyridin-3-yl]sulfonylurea
Property Insights of 1-Tert-butyl-3-[2-(2-chlorophenyl)sulfanylpyridin-3-yl]sulfonylurea
The XLogP value of 3.4 indicates that 1-Tert-butyl-3-[2-(2-chlorophenyl)sulfanylpyridin-3-yl]sulfonylurea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 122.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Tert-butyl-3-[2-(2-chlorophenyl)sulfanylpyridin-3-yl]sulfonylurea. Following Lipinski's Rule of Five, 1-Tert-butyl-3-[2-(2-chlorophenyl)sulfanylpyridin-3-yl]sulfonylurea has 2 hydrogen bond donor(s) and 5 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 1-Tert-butyl-3-[2-(2-chlorophenyl)sulfanylpyridin-3-yl]sulfonylurea?
The CAS number of 1-Tert-butyl-3-[2-(2-chlorophenyl)sulfanylpyridin-3-yl]sulfonylurea is 84881-83-4.
What is the molecular formula of 1-Tert-butyl-3-[2-(2-chlorophenyl)sulfanylpyridin-3-yl]sulfonylurea?
The molecular formula of 1-Tert-butyl-3-[2-(2-chlorophenyl)sulfanylpyridin-3-yl]sulfonylurea is C16H18ClN3O3S2.
What is the molecular weight of 1-Tert-butyl-3-[2-(2-chlorophenyl)sulfanylpyridin-3-yl]sulfonylurea?
The molecular weight of 1-Tert-butyl-3-[2-(2-chlorophenyl)sulfanylpyridin-3-yl]sulfonylurea is 399.05 g/mol.
Where can I buy 1-Tert-butyl-3-[2-(2-chlorophenyl)sulfanylpyridin-3-yl]sulfonylurea?
You can request a quote for 1-Tert-butyl-3-[2-(2-chlorophenyl)sulfanylpyridin-3-yl]sulfonylurea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Tert-butyl-3-[2-(2-chlorophenyl)sulfanylpyridin-3-yl]sulfonylurea?
Yes, KEHONG BIO provides custom synthesis services for 1-Tert-butyl-3-[2-(2-chlorophenyl)sulfanylpyridin-3-yl]sulfonylurea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.