4-Methoxy-3-phenylisothiazole
TL;DR: 4-Methoxy-3-phenylisothiazole (CAS 19574-25-5) is a chemical compound with molecular formula C10H9NOS and molecular weight 191.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methoxy-3-phenyl-1,2-thiazole
Also Known As: 4-Methoxy-3-phenylisothiazole, 4-methoxy-3-phenyl-1,2-thiazole, Isothiazole, 4-methoxy-3-phenyl-, 4-Methoxy-3-phenylisothiazole #
| Molecular Formula | C10H9NOS |
|---|---|
| Molecular Weight | 191.04 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 50.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 191.04048 |
| Heavy Atoms | 13 |
| Complexity | 159.0 |
Chemical Identifiers
| CAS Number | 19574-25-5 |
|---|---|
| SMILES | COC1=CSN=C1C2=CC=CC=C2 |
| InChIKey | HIMLHVMWZAUZDW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Methoxy-3-phenylisothiazole (CAS 19574-25-5), with molecular formula C10H9NOS and molecular weight 191.04 g/mol. IUPAC: 4-methoxy-3-phenyl-1,2-thiazole.
Chemical Property Profile of 4-Methoxy-3-phenylisothiazole
Property Insights of 4-Methoxy-3-phenylisothiazole
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methoxy-3-phenylisothiazole. With a topological polar surface area (TPSA) of 50.4 Ų, 4-Methoxy-3-phenylisothiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Methoxy-3-phenylisothiazole has 0 hydrogen bond donor(s) and 3 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-Methoxy-3-phenylisothiazole?
The CAS number of 4-Methoxy-3-phenylisothiazole is 19574-25-5.
What is the molecular formula of 4-Methoxy-3-phenylisothiazole?
The molecular formula of 4-Methoxy-3-phenylisothiazole is C10H9NOS.
What is the molecular weight of 4-Methoxy-3-phenylisothiazole?
The molecular weight of 4-Methoxy-3-phenylisothiazole is 191.04 g/mol.
Where can I buy 4-Methoxy-3-phenylisothiazole?
You can request a quote for 4-Methoxy-3-phenylisothiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methoxy-3-phenylisothiazole?
Yes, KEHONG BIO provides custom synthesis services for 4-Methoxy-3-phenylisothiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.