1,2-Oxazole-5-carbothioamide
TL;DR: 1,2-Oxazole-5-carbothioamide (CAS 175334-72-2) is a chemical compound with molecular formula C4H4N2OS and molecular weight 128.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2-oxazole-5-carbothioamide
Also Known As: Isoxazole-5-carbothioamide, 1,2-oxazole-5-carbothioamide, 5-Isoxazolecarbothioamide, Isoxazole-5-thiocarboxamide, Isoxazole-5-carbothioic acid amide
| Molecular Formula | C4H4N2OS |
|---|---|
| Molecular Weight | 128.00 g/mol |
| LogP | 0.3088 |
| Topological Polar Surface Area | 52.05 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 128.00444 |
| Heavy Atoms | 8 |
| Complexity | 181.92819 |
Chemical Identifiers
| CAS Number | 175334-72-2 |
|---|---|
| SMILES | C1=C(ON=C1)C(=S)N |
Product Overview
1,2-Oxazole-5-carbothioamide (CAS 175334-72-2), with molecular formula C4H4N2OS and molecular weight 128.00 g/mol. IUPAC: 1,2-oxazole-5-carbothioamide.
Chemical Property Profile of 1,2-Oxazole-5-carbothioamide
Property Insights of 1,2-Oxazole-5-carbothioamide
The XLogP value of 0.3088 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2-Oxazole-5-carbothioamide. With a topological polar surface area (TPSA) of 52.05 Ų, 1,2-Oxazole-5-carbothioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2-Oxazole-5-carbothioamide has 1 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 1,2-Oxazole-5-carbothioamide?
The CAS number of 1,2-Oxazole-5-carbothioamide is 175334-72-2.
What is the molecular formula of 1,2-Oxazole-5-carbothioamide?
The molecular formula of 1,2-Oxazole-5-carbothioamide is C4H4N2OS.
What is the molecular weight of 1,2-Oxazole-5-carbothioamide?
The molecular weight of 1,2-Oxazole-5-carbothioamide is 128.00 g/mol.
Where can I buy 1,2-Oxazole-5-carbothioamide?
You can request a quote for 1,2-Oxazole-5-carbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-Oxazole-5-carbothioamide?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Oxazole-5-carbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.