A2930/0123326
TL;DR: A2930/0123326 (CAS 494745-06-1) is a chemical compound with molecular formula C10H9F3O5S2 and molecular weight 329.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-hydroxy-5-(2-methoxy-2-oxoethyl)sulfanyl-4-(trifluoromethyl)thiophene-2-carboxylate
Also Known As: A2930/0123326, methyl 3-hydroxy-5-[(2-methoxy-2-oxoethyl)sulfanyl]-4-(trifluoromethyl)thiophene-2-carboxylate, methyl 3-hydroxy-5-((2-methoxy-2-oxoethyl)thio)-4-(trifluoromethyl)thiophene-2-carboxylate, methyl 2-[(5E)-5-[hydroxy(methoxy)methylidene]-4-oxo-3-(trifluoromethyl)thiophen-2-yl]sulfanylacetate, methyl 2-[5-[hydroxy(methoxy)methylidene]-4-oxo-3-(trifluoromethyl)thiophen-2-yl]sulfanylacetate
| Molecular Formula | C10H9F3O5S2 |
|---|---|
| Molecular Weight | 329.98 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 126.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 6 |
| Exact Mass | 329.98434 |
| Heavy Atoms | 20 |
| Complexity | 376.0 |
Chemical Identifiers
| CAS Number | 494745-06-1 |
|---|---|
| SMILES | COC(=O)CSC1=C(C(=C(S1)C(=O)OC)O)C(F)(F)F |
| InChIKey | HACRDSTWVCAUQY-UHFFFAOYSA-N |
Product Overview
A2930/0123326 (CAS 494745-06-1), with molecular formula C10H9F3O5S2 and molecular weight 329.98 g/mol. IUPAC: methyl 3-hydroxy-5-(2-methoxy-2-oxoethyl)sulfanyl-4-(trifluoromethyl)thiophene-2-carboxylate.
Chemical Property Profile of A2930/0123326
Property Insights of A2930/0123326
The XLogP value of 3.6 indicates that A2930/0123326 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 126.0 Ų falls within the moderate polarity range, balancing permeability and solubility for A2930/0123326. Following Lipinski's Rule of Five, A2930/0123326 has 1 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 A2930/0123326?
The CAS number of A2930/0123326 is 494745-06-1.
What is the molecular formula of A2930/0123326?
The molecular formula of A2930/0123326 is C10H9F3O5S2.
What is the molecular weight of A2930/0123326?
The molecular weight of A2930/0123326 is 329.98 g/mol.
Where can I buy A2930/0123326?
You can request a quote for A2930/0123326 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2930/0123326?
Yes, KEHONG BIO provides custom synthesis services for A2930/0123326 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.