1-(5-Amino-3-methyl-1,2-thiazol-4-yl)ethan-1-one
TL;DR: 1-(5-Amino-3-methyl-1,2-thiazol-4-yl)ethan-1-one (CAS 871673-30-2) is a chemical compound with molecular formula C6H8N2OS and molecular weight 156.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(5-amino-3-methyl-1,2-thiazol-4-yl)ethanone
Also Known As: 1-(5-amino-3-methylisothiazol-4-yl)ethanone, 1-(5-amino-3-methyl-4-isothiazolyl)ethanone, 4-acetyl-5-amino-3-methylisothiazole, 1-(5-amino-3-methyl-1,2-thiazol-4-yl)ethanone, 1-(5-amino-3-methyl-1,2-thiazol-4-yl)ethan-1-one
| Molecular Formula | C6H8N2OS |
|---|---|
| Molecular Weight | 156.04 g/mol |
| LogP | 1.23632 |
| Topological Polar Surface Area | 55.98 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 156.03574 |
| Heavy Atoms | 10 |
| Complexity | 247.21158 |
Chemical Identifiers
| CAS Number | 871673-30-2 |
|---|---|
| SMILES | CC1=NSC(=C1C(=O)C)N |
Product Overview
1-(5-Amino-3-methyl-1,2-thiazol-4-yl)ethan-1-one (CAS 871673-30-2), with molecular formula C6H8N2OS and molecular weight 156.04 g/mol. IUPAC: 1-(5-amino-3-methyl-1,2-thiazol-4-yl)ethanone.
Chemical Property Profile of 1-(5-Amino-3-methyl-1,2-thiazol-4-yl)ethan-1-one
Property Insights of 1-(5-Amino-3-methyl-1,2-thiazol-4-yl)ethan-1-one
The XLogP value of 1.23632 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(5-Amino-3-methyl-1,2-thiazol-4-yl)ethan-1-one. With a topological polar surface area (TPSA) of 55.98 Ų, 1-(5-Amino-3-methyl-1,2-thiazol-4-yl)ethan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(5-Amino-3-methyl-1,2-thiazol-4-yl)ethan-1-one has 1 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 1-(5-Amino-3-methyl-1,2-thiazol-4-yl)ethan-1-one?
The CAS number of 1-(5-Amino-3-methyl-1,2-thiazol-4-yl)ethan-1-one is 871673-30-2.
What is the molecular formula of 1-(5-Amino-3-methyl-1,2-thiazol-4-yl)ethan-1-one?
The molecular formula of 1-(5-Amino-3-methyl-1,2-thiazol-4-yl)ethan-1-one is C6H8N2OS.
What is the molecular weight of 1-(5-Amino-3-methyl-1,2-thiazol-4-yl)ethan-1-one?
The molecular weight of 1-(5-Amino-3-methyl-1,2-thiazol-4-yl)ethan-1-one is 156.04 g/mol.
Where can I buy 1-(5-Amino-3-methyl-1,2-thiazol-4-yl)ethan-1-one?
You can request a quote for 1-(5-Amino-3-methyl-1,2-thiazol-4-yl)ethan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(5-Amino-3-methyl-1,2-thiazol-4-yl)ethan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(5-Amino-3-methyl-1,2-thiazol-4-yl)ethan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.