氯唑沙宗
TL;DR: 氯唑沙宗 (CAS 95-25-0) is a chemical compound with molecular formula C7H4ClNO2 and molecular weight 168.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
氯唑沙宗
5-chloro-3H-1,3-benzoxazol-2-one
Also Known As: chlorzoxazone, Paraflex, Chloroxazone, Chlorzoxazon, Myoflexine
| Molecular Formula | C7H4ClNO2 |
|---|---|
| Molecular Weight | 168.99 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 168.99306 |
| Heavy Atoms | 11 |
| Complexity | 185.0 |
| Melting Point | 191-191.5 |
| Solubility | 1000 |
Chemical Identifiers
| CAS Number | 95-25-0 |
|---|---|
| SMILES | C1=CC2=C(C=C1Cl)NC(=O)O2 |
| InChIKey | TZFWDZFKRBELIQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
氯唑沙宗 (CAS 95-25-0), with molecular formula C7H4ClNO2 and molecular weight 168.99 g/mol. IUPAC: 5-chloro-3H-1,3-benzoxazol-2-one.
Chemical Property Profile of 氯唑沙宗
Property Insights of 氯唑沙宗
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 氯唑沙宗. With a topological polar surface area (TPSA) of 38.3 Ų, 氯唑沙宗 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 氯唑沙宗 has 1 hydrogen bond donor(s) and 2 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 氯唑沙宗?
The CAS number of 氯唑沙宗 is 95-25-0.
What is the molecular formula of 氯唑沙宗?
The molecular formula of 氯唑沙宗 is C7H4ClNO2.
What is the molecular weight of 氯唑沙宗?
The molecular weight of 氯唑沙宗 is 168.99 g/mol.
Where can I buy 氯唑沙宗?
You can request a quote for 氯唑沙宗 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 氯唑沙宗?
Yes, KEHONG BIO provides custom synthesis services for 氯唑沙宗 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.