RepSox
TL;DR: RepSox (CAS 446859-33-2) is a chemical compound with molecular formula C17H13N5 and molecular weight 287.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridine
Also Known As: RepSox, ALK5 Inhibitor II, ALK5 Inhibitor, 1vjy, RepSox (GMP)
| Molecular Formula | C17H13N5 |
|---|---|
| Molecular Weight | 287.12 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 67.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 287.1171 |
| Heavy Atoms | 22 |
| Complexity | 376.0 |
Chemical Identifiers
| CAS Number | 446859-33-2 |
|---|---|
| SMILES | CC1=NC(=CC=C1)C2=C(C=NN2)C3=NC4=C(C=C3)N=CC=C4 |
| InChIKey | LBPKYPYHDKKRFS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
RepSox (CAS 446859-33-2), with molecular formula C17H13N5 and molecular weight 287.12 g/mol. IUPAC: 2-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridine.
Chemical Property Profile of RepSox
Property Insights of RepSox
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RepSox. The TPSA of 67.4 Ų falls within the moderate polarity range, balancing permeability and solubility for RepSox. Following Lipinski's Rule of Five, RepSox has 1 hydrogen bond donor(s) and 4 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 RepSox?
The CAS number of RepSox is 446859-33-2.
What is the molecular formula of RepSox?
The molecular formula of RepSox is C17H13N5.
What is the molecular weight of RepSox?
The molecular weight of RepSox is 287.12 g/mol.
Where can I buy RepSox?
You can request a quote for RepSox directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RepSox?
Yes, KEHONG BIO provides custom synthesis services for RepSox and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.