2-(2-Chloropyrimidin-4-yl)sulfanyl-1,3-benzoxazole
TL;DR: 2-(2-Chloropyrimidin-4-yl)sulfanyl-1,3-benzoxazole (CAS 353260-36-3) is a chemical compound with molecular formula C11H6ClN3OS and molecular weight 262.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-chloropyrimidin-4-yl)sulfanyl-1,3-benzoxazole
Also Known As: 2-(2-chloropyrimidin-4-yl)sulfanyl-1,3-benzoxazole, 2-[(2-chloro-4-pyrimidinyl)sulfanyl]-1,3-benzoxazole, AI-204/31717007
| Molecular Formula | C11H6ClN3OS |
|---|---|
| Molecular Weight | 262.99 g/mol |
| LogP | 3.4224 |
| Topological Polar Surface Area | 51.81 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 262.992 |
| Heavy Atoms | 17 |
| Complexity | 637.38025 |
Chemical Identifiers
| CAS Number | 353260-36-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C(O2)SC3=NC(=NC=C3)Cl |
Product Overview
2-(2-Chloropyrimidin-4-yl)sulfanyl-1,3-benzoxazole (CAS 353260-36-3), with molecular formula C11H6ClN3OS and molecular weight 262.99 g/mol. IUPAC: 2-(2-chloropyrimidin-4-yl)sulfanyl-1,3-benzoxazole.
Chemical Property Profile of 2-(2-Chloropyrimidin-4-yl)sulfanyl-1,3-benzoxazole
Property Insights of 2-(2-Chloropyrimidin-4-yl)sulfanyl-1,3-benzoxazole
The XLogP value of 3.4224 indicates that 2-(2-Chloropyrimidin-4-yl)sulfanyl-1,3-benzoxazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.81 Ų, 2-(2-Chloropyrimidin-4-yl)sulfanyl-1,3-benzoxazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2-Chloropyrimidin-4-yl)sulfanyl-1,3-benzoxazole has 0 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 2-(2-Chloropyrimidin-4-yl)sulfanyl-1,3-benzoxazole?
The CAS number of 2-(2-Chloropyrimidin-4-yl)sulfanyl-1,3-benzoxazole is 353260-36-3.
What is the molecular formula of 2-(2-Chloropyrimidin-4-yl)sulfanyl-1,3-benzoxazole?
The molecular formula of 2-(2-Chloropyrimidin-4-yl)sulfanyl-1,3-benzoxazole is C11H6ClN3OS.
What is the molecular weight of 2-(2-Chloropyrimidin-4-yl)sulfanyl-1,3-benzoxazole?
The molecular weight of 2-(2-Chloropyrimidin-4-yl)sulfanyl-1,3-benzoxazole is 262.99 g/mol.
Where can I buy 2-(2-Chloropyrimidin-4-yl)sulfanyl-1,3-benzoxazole?
You can request a quote for 2-(2-Chloropyrimidin-4-yl)sulfanyl-1,3-benzoxazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Chloropyrimidin-4-yl)sulfanyl-1,3-benzoxazole?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Chloropyrimidin-4-yl)sulfanyl-1,3-benzoxazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.