Ethanone, 1-(2-(2-propenylamino)-4-thiazolyl)-
TL;DR: Ethanone, 1-(2-(2-propenylamino)-4-thiazolyl)- (CAS 5898-39-5) is a chemical compound with molecular formula C8H10N2OS and molecular weight 182.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-(prop-2-enylamino)-1,3-thiazol-4-yl]ethanone
Also Known As: 1-(2-(2-Propenylamino)-4-thiazolyl)ethanone, Ethanone, 1-(2-(2-propenylamino)-4-thiazolyl)-, 1-(2-allylamino-thiazol-4-yl)-ethanone, Ketone, 2-(allylamino)-4-thiazolyl methyl, 1-[2-(prop-2-enylamino)-1,3-thiazol-4-yl]ethanone
| Molecular Formula | C8H10N2OS |
|---|---|
| Molecular Weight | 182.05 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 70.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 182.05139 |
| Heavy Atoms | 12 |
| Complexity | 184.0 |
Chemical Identifiers
| CAS Number | 5898-39-5 |
|---|---|
| SMILES | CC(=O)C1=CSC(=N1)NCC=C |
| InChIKey | ABEZVMNDDJJLMD-UHFFFAOYSA-N |
Product Overview
Ethanone, 1-(2-(2-propenylamino)-4-thiazolyl)- (CAS 5898-39-5), with molecular formula C8H10N2OS and molecular weight 182.05 g/mol. IUPAC: 1-[2-(prop-2-enylamino)-1,3-thiazol-4-yl]ethanone.
Chemical Property Profile of Ethanone, 1-(2-(2-propenylamino)-4-thiazolyl)-
Property Insights of Ethanone, 1-(2-(2-propenylamino)-4-thiazolyl)-
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethanone, 1-(2-(2-propenylamino)-4-thiazolyl)-. The TPSA of 70.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethanone, 1-(2-(2-propenylamino)-4-thiazolyl)-. Following Lipinski's Rule of Five, Ethanone, 1-(2-(2-propenylamino)-4-thiazolyl)- 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 Ethanone, 1-(2-(2-propenylamino)-4-thiazolyl)-?
The CAS number of Ethanone, 1-(2-(2-propenylamino)-4-thiazolyl)- is 5898-39-5.
What is the molecular formula of Ethanone, 1-(2-(2-propenylamino)-4-thiazolyl)-?
The molecular formula of Ethanone, 1-(2-(2-propenylamino)-4-thiazolyl)- is C8H10N2OS.
What is the molecular weight of Ethanone, 1-(2-(2-propenylamino)-4-thiazolyl)-?
The molecular weight of Ethanone, 1-(2-(2-propenylamino)-4-thiazolyl)- is 182.05 g/mol.
Where can I buy Ethanone, 1-(2-(2-propenylamino)-4-thiazolyl)-?
You can request a quote for Ethanone, 1-(2-(2-propenylamino)-4-thiazolyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanone, 1-(2-(2-propenylamino)-4-thiazolyl)-?
Yes, KEHONG BIO provides custom synthesis services for Ethanone, 1-(2-(2-propenylamino)-4-thiazolyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.