5-Isoxazolamine, 3-(2-thienyl)-, monohydrochloride
TL;DR: 5-Isoxazolamine, 3-(2-thienyl)-, monohydrochloride (CAS 44918-10-7) is a chemical compound with molecular formula C7H7ClN2OS and molecular weight 202.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-thiophen-2-yl-1,2-oxazol-5-amine;hydrochloride
Also Known As: 3-(2-Thienyl)-5-isoxazolamine monohydrochloride, 5-Isoxazolamine, 3-(2-thienyl)-, monohydrochloride, 3-(thiophen-2-yl)-1,2-oxazol-5-amine hydrochloride(1:1), 3-(Thiophen-2-yl)isoxazol-5-amine hydrochloride, 3-thiophen-2-yloxazol-5-amine hydrochloride
| Molecular Formula | C7H7ClN2OS |
|---|---|
| Molecular Weight | 202.00 g/mol |
| LogP | 2.4071 |
| Topological Polar Surface Area | 80.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 201.99677 |
| Heavy Atoms | 12 |
| Complexity | 144.0 |
Chemical Identifiers
| CAS Number | 44918-10-7 |
|---|---|
| SMILES | C1=CSC(=C1)C2=NOC(=C2)N.Cl |
| InChIKey | SLUAZCKBSMNIFI-UHFFFAOYSA-N |
Product Overview
5-Isoxazolamine, 3-(2-thienyl)-, monohydrochloride (CAS 44918-10-7), with molecular formula C7H7ClN2OS and molecular weight 202.00 g/mol. IUPAC: 3-thiophen-2-yl-1,2-oxazol-5-amine;hydrochloride.
Chemical Property Profile of 5-Isoxazolamine, 3-(2-thienyl)-, monohydrochloride
Property Insights of 5-Isoxazolamine, 3-(2-thienyl)-, monohydrochloride
The XLogP value of 2.4071 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Isoxazolamine, 3-(2-thienyl)-, monohydrochloride. The TPSA of 80.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Isoxazolamine, 3-(2-thienyl)-, monohydrochloride. Following Lipinski's Rule of Five, 5-Isoxazolamine, 3-(2-thienyl)-, monohydrochloride has 2 hydrogen bond donor(s) and 4 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 5-Isoxazolamine, 3-(2-thienyl)-, monohydrochloride?
The CAS number of 5-Isoxazolamine, 3-(2-thienyl)-, monohydrochloride is 44918-10-7.
What is the molecular formula of 5-Isoxazolamine, 3-(2-thienyl)-, monohydrochloride?
The molecular formula of 5-Isoxazolamine, 3-(2-thienyl)-, monohydrochloride is C7H7ClN2OS.
What is the molecular weight of 5-Isoxazolamine, 3-(2-thienyl)-, monohydrochloride?
The molecular weight of 5-Isoxazolamine, 3-(2-thienyl)-, monohydrochloride is 202.00 g/mol.
Where can I buy 5-Isoxazolamine, 3-(2-thienyl)-, monohydrochloride?
You can request a quote for 5-Isoxazolamine, 3-(2-thienyl)-, monohydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Isoxazolamine, 3-(2-thienyl)-, monohydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 5-Isoxazolamine, 3-(2-thienyl)-, monohydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.