C-Pyrazin-2-yl-methylamine
TL;DR: C-Pyrazin-2-yl-methylamine (CAS 39204-49-4) is a chemical compound with molecular formula C21H24ClF3N4O and molecular weight 440.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[2-(azepan-1-yl)ethoxy]-1-[3-(trifluoromethyl)phenyl]pyrazolo[5,4-b]pyridine;hydrochloride
Also Known As: C-Pyrazin-2-yl-methylamine, 1H-Pyrazolo(3,4-b)pyridine, 3-(2-(hexahydro-1H-azepin-1-yl)ethoxy)-1-(3-(trifluoromethyl)phenyl)-, monohydrochloride, 3-(2-(Azepan-1-yl)ethoxy)-1-(3-(trifluoromethyl)phenyl)-1H-pyrazolo[3,4-b]pyridine hydrochloride, 3-[2-(azepan-1-yl)ethoxy]-1-[3-(trifluoromethyl)phenyl]-1h-pyrazolo[3,4-b]pyridine hydrochloride(1:1), 1-[2-({1-[3-(trifluoromethyl)phenyl]-1H-pyrazolo[3,4-b]pyridin-3-yl}oxy)ethyl]azepane hydrochloride
| Molecular Formula | C21H24ClF3N4O |
|---|---|
| Molecular Weight | 440.16 g/mol |
| LogP | 5.1159 |
| Topological Polar Surface Area | 43.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 440.1591 |
| Heavy Atoms | 30 |
| Complexity | 513.0 |
Chemical Identifiers
| CAS Number | 39204-49-4 |
|---|---|
| SMILES | C1CCCN(CC1)CCOC2=NN(C3=C2C=CC=N3)C4=CC=CC(=C4)C(F)(F)F.Cl |
| InChIKey | OLMXMEBAUWGILT-UHFFFAOYSA-N |
Product Overview
C-Pyrazin-2-yl-methylamine (CAS 39204-49-4), with molecular formula C21H24ClF3N4O and molecular weight 440.16 g/mol. IUPAC: 3-[2-(azepan-1-yl)ethoxy]-1-[3-(trifluoromethyl)phenyl]pyrazolo[5,4-b]pyridine;hydrochloride.
Chemical Property Profile of C-Pyrazin-2-yl-methylamine
Property Insights of C-Pyrazin-2-yl-methylamine
The XLogP value of 5.1159 indicates that C-Pyrazin-2-yl-methylamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.2 Ų, C-Pyrazin-2-yl-methylamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, C-Pyrazin-2-yl-methylamine has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of C-Pyrazin-2-yl-methylamine?
The CAS number of C-Pyrazin-2-yl-methylamine is 39204-49-4.
What is the molecular formula of C-Pyrazin-2-yl-methylamine?
The molecular formula of C-Pyrazin-2-yl-methylamine is C21H24ClF3N4O.
What is the molecular weight of C-Pyrazin-2-yl-methylamine?
The molecular weight of C-Pyrazin-2-yl-methylamine is 440.16 g/mol.
Where can I buy C-Pyrazin-2-yl-methylamine?
You can request a quote for C-Pyrazin-2-yl-methylamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C-Pyrazin-2-yl-methylamine?
Yes, KEHONG BIO provides custom synthesis services for C-Pyrazin-2-yl-methylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.