TbetaR-I Inhibitor
TL;DR: TbetaR-I Inhibitor (CAS 396129-53-6) is a chemical compound with molecular formula C17H12N4 and molecular weight 272.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(5-pyridin-2-yl-1H-pyrazol-4-yl)quinoline
Also Known As: TbetaR-I Inhibitor, ALK5 Inhibitor I, 4-(3-(pyridin-2-yl)-1H-pyrazol-4-yl)quinoline, TGF-beta RI Kinase Inhibitor, TGF-beta1 inhibitor
| Molecular Formula | C17H12N4 |
|---|---|
| Molecular Weight | 272.11 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 54.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 272.1062 |
| Heavy Atoms | 21 |
| Complexity | 348.0 |
Chemical Identifiers
| CAS Number | 396129-53-6 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CC=N2)C3=C(NN=C3)C4=CC=CC=N4 |
| InChIKey | IBCXZJCWDGCXQT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
TbetaR-I Inhibitor (CAS 396129-53-6), with molecular formula C17H12N4 and molecular weight 272.11 g/mol. IUPAC: 4-(5-pyridin-2-yl-1H-pyrazol-4-yl)quinoline.
Chemical Property Profile of TbetaR-I Inhibitor
Property Insights of TbetaR-I Inhibitor
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for TbetaR-I Inhibitor. With a topological polar surface area (TPSA) of 54.5 Ų, TbetaR-I Inhibitor exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, TbetaR-I Inhibitor has 1 hydrogen bond donor(s) and 3 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 TbetaR-I Inhibitor?
The CAS number of TbetaR-I Inhibitor is 396129-53-6.
What is the molecular formula of TbetaR-I Inhibitor?
The molecular formula of TbetaR-I Inhibitor is C17H12N4.
What is the molecular weight of TbetaR-I Inhibitor?
The molecular weight of TbetaR-I Inhibitor is 272.11 g/mol.
Where can I buy TbetaR-I Inhibitor?
You can request a quote for TbetaR-I Inhibitor directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for TbetaR-I Inhibitor?
Yes, KEHONG BIO provides custom synthesis services for TbetaR-I Inhibitor and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.