SQ 65442
TL;DR: SQ 65442 (CAS 5210-40-2) is a chemical compound with molecular formula C13H17N3O2S and molecular weight 279.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 1-ethyl-4-ethylsulfanylpyrazolo[3,4-b]pyridine-5-carboxylate
Also Known As: SQ 65442, Sq 65,442, SQ-65,442, Ethyl 1-ethyl-4-ethylthio-1H-pyrazolo(3,4-b)pyridine-5-carboxylate, Ethyl 1-ethyl-4-(ethylthio)-1H-pyrazolo[3,4-b]pyridine-5-carboxylate
| Molecular Formula | C13H17N3O2S |
|---|---|
| Molecular Weight | 279.10 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 82.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 279.10416 |
| Heavy Atoms | 19 |
| Complexity | 316.0 |
Chemical Identifiers
| CAS Number | 5210-40-2 |
|---|---|
| SMILES | CCN1C2=NC=C(C(=C2C=N1)SCC)C(=O)OCC |
| InChIKey | DAPJSAWQRYKJBL-UHFFFAOYSA-N |
Product Overview
SQ 65442 (CAS 5210-40-2), with molecular formula C13H17N3O2S and molecular weight 279.10 g/mol. IUPAC: ethyl 1-ethyl-4-ethylsulfanylpyrazolo[3,4-b]pyridine-5-carboxylate.
Chemical Property Profile of SQ 65442
Property Insights of SQ 65442
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for SQ 65442. The TPSA of 82.3 Ų falls within the moderate polarity range, balancing permeability and solubility for SQ 65442. Following Lipinski's Rule of Five, SQ 65442 has 0 hydrogen bond donor(s) and 5 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 SQ 65442?
The CAS number of SQ 65442 is 5210-40-2.
What is the molecular formula of SQ 65442?
The molecular formula of SQ 65442 is C13H17N3O2S.
What is the molecular weight of SQ 65442?
The molecular weight of SQ 65442 is 279.10 g/mol.
Where can I buy SQ 65442?
You can request a quote for SQ 65442 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for SQ 65442?
Yes, KEHONG BIO provides custom synthesis services for SQ 65442 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.