A2323/0097969
TL;DR: A2323/0097969 (CAS 352317-43-2) is a chemical compound with molecular formula C16H20F3N3O4S and molecular weight 407.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[(3-cyano-4-ethyl-5-methylthiophen-2-yl)amino]-2-(ethoxycarbonylamino)-3,3,3-trifluoropropanoate
Also Known As: A2323/0097969, ethyl 2-((3-cyano-4-ethyl-5-methylthiophen-2-yl)amino)-2-((ethoxycarbonyl)amino)-3,3,3-trifluoropropanoate, Ethyl 2-[(3-cyano-4-ethyl-5-methyl-2-thienyl)amino]-2-[(ethoxycarbonyl)amino]-3,3,3-trifluoropropanoate #, ethyl 2-[(3-cyano-4-ethyl-5-methylthiophen-2-yl)amino]-2-(ethoxycarbonylamino)-3,3,3-trifluoropropanoate, ETHYL 2-[(3-CYANO-4-ETHYL-5-METHYLTHIOPHEN-2-YL)AMINO]-2-[(ETHOXYCARBONYL)AMINO]-3,3,3-TRIFLUOROPROPANOATE
| Molecular Formula | C16H20F3N3O4S |
|---|---|
| Molecular Weight | 407.11 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 129.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 9 |
| Exact Mass | 407.11267 |
| Heavy Atoms | 27 |
| Complexity | 595.0 |
Chemical Identifiers
| CAS Number | 352317-43-2 |
|---|---|
| SMILES | CCC1=C(SC(=C1C#N)NC(C(=O)OCC)(C(F)(F)F)NC(=O)OCC)C |
| InChIKey | QRNKZGOCNUELPG-UHFFFAOYSA-N |
Product Overview
A2323/0097969 (CAS 352317-43-2), with molecular formula C16H20F3N3O4S and molecular weight 407.11 g/mol. IUPAC: ethyl 2-[(3-cyano-4-ethyl-5-methylthiophen-2-yl)amino]-2-(ethoxycarbonylamino)-3,3,3-trifluoropropanoate.
Chemical Property Profile of A2323/0097969
Property Insights of A2323/0097969
The XLogP value of 4.8 indicates that A2323/0097969 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 129.0 Ų falls within the moderate polarity range, balancing permeability and solubility for A2323/0097969. Following Lipinski's Rule of Five, A2323/0097969 has 2 hydrogen bond donor(s) and 10 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 A2323/0097969?
The CAS number of A2323/0097969 is 352317-43-2.
What is the molecular formula of A2323/0097969?
The molecular formula of A2323/0097969 is C16H20F3N3O4S.
What is the molecular weight of A2323/0097969?
The molecular weight of A2323/0097969 is 407.11 g/mol.
Where can I buy A2323/0097969?
You can request a quote for A2323/0097969 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2323/0097969?
Yes, KEHONG BIO provides custom synthesis services for A2323/0097969 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.