JNK inhibitor IX
TL;DR: JNK inhibitor IX (CAS 312917-14-9) is a chemical compound with molecular formula C20H16N2OS and molecular weight 332.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)naphthalene-1-carboxamide
Also Known As: JNK Inhibitor IX, TCS JNK 5a, JNKInhibitorIX, TCS-JNK-5a, N-(3-cyano-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)-1-naphthamide
| Molecular Formula | C20H16N2OS |
|---|---|
| Molecular Weight | 332.10 g/mol |
| LogP | 5.5 |
| Topological Polar Surface Area | 81.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 332.09833 |
| Heavy Atoms | 24 |
| Complexity | 527.0 |
Chemical Identifiers
| CAS Number | 312917-14-9 |
|---|---|
| SMILES | C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC=CC4=CC=CC=C43)C#N |
| InChIKey | WQGDQGAFSDMBLA-UHFFFAOYSA-N |
Product Overview
JNK inhibitor IX (CAS 312917-14-9), with molecular formula C20H16N2OS and molecular weight 332.10 g/mol. IUPAC: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)naphthalene-1-carboxamide.
Chemical Property Profile of JNK inhibitor IX
Property Insights of JNK inhibitor IX
The XLogP value of 5.5 indicates that JNK inhibitor IX is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.1 Ų falls within the moderate polarity range, balancing permeability and solubility for JNK inhibitor IX. Following Lipinski's Rule of Five, JNK inhibitor IX has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of JNK inhibitor IX?
The CAS number of JNK inhibitor IX is 312917-14-9.
What is the molecular formula of JNK inhibitor IX?
The molecular formula of JNK inhibitor IX is C20H16N2OS.
What is the molecular weight of JNK inhibitor IX?
The molecular weight of JNK inhibitor IX is 332.10 g/mol.
Where can I buy JNK inhibitor IX?
You can request a quote for JNK inhibitor IX directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for JNK inhibitor IX?
Yes, KEHONG BIO provides custom synthesis services for JNK inhibitor IX and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.