Guanidine, 1-tert-butyl-2-cyano-3-(2-pyridylethyl)-
TL;DR: Guanidine, 1-tert-butyl-2-cyano-3-(2-pyridylethyl)- (CAS 67026-91-9) is a chemical compound with molecular formula C13H19N5 and molecular weight 245.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-tert-butyl-3-cyano-2-(2-pyridin-2-ylethyl)guanidine
Also Known As: 1-tert-Butyl-2-cyano-3-(2-pyridylethyl)guanidine, GUANIDINE, 1-tert-BUTYL-2-CYANO-3-(2-PYRIDYLETHYL)-, 1-tert-Butyl-2-cyano-3-[2-(2-pyridyl)ethyl]guanidine, 1-tert-butyl-3-cyano-2-(2-pyridin-2-ylethyl)guanidine, 1-TERT-BUTYL-2-CYANO-3-(PYRIDIN-2-YLETHYL)GUANIDINE
| Molecular Formula | C13H19N5 |
|---|---|
| Molecular Weight | 245.16 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 73.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 245.16405 |
| Heavy Atoms | 18 |
| Complexity | 320.0 |
Chemical Identifiers
| CAS Number | 67026-91-9 |
|---|---|
| SMILES | CC(C)(C)NC(=NCCC1=CC=CC=N1)NC#N |
| InChIKey | XHAQCRIDOWMWOD-UHFFFAOYSA-N |
Product Overview
Guanidine, 1-tert-butyl-2-cyano-3-(2-pyridylethyl)- (CAS 67026-91-9), with molecular formula C13H19N5 and molecular weight 245.16 g/mol. IUPAC: 1-tert-butyl-3-cyano-2-(2-pyridin-2-ylethyl)guanidine.
Chemical Property Profile of Guanidine, 1-tert-butyl-2-cyano-3-(2-pyridylethyl)-
Property Insights of Guanidine, 1-tert-butyl-2-cyano-3-(2-pyridylethyl)-
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Guanidine, 1-tert-butyl-2-cyano-3-(2-pyridylethyl)-. The TPSA of 73.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Guanidine, 1-tert-butyl-2-cyano-3-(2-pyridylethyl)-. Following Lipinski's Rule of Five, Guanidine, 1-tert-butyl-2-cyano-3-(2-pyridylethyl)- has 2 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 Guanidine, 1-tert-butyl-2-cyano-3-(2-pyridylethyl)-?
The CAS number of Guanidine, 1-tert-butyl-2-cyano-3-(2-pyridylethyl)- is 67026-91-9.
What is the molecular formula of Guanidine, 1-tert-butyl-2-cyano-3-(2-pyridylethyl)-?
The molecular formula of Guanidine, 1-tert-butyl-2-cyano-3-(2-pyridylethyl)- is C13H19N5.
What is the molecular weight of Guanidine, 1-tert-butyl-2-cyano-3-(2-pyridylethyl)-?
The molecular weight of Guanidine, 1-tert-butyl-2-cyano-3-(2-pyridylethyl)- is 245.16 g/mol.
Where can I buy Guanidine, 1-tert-butyl-2-cyano-3-(2-pyridylethyl)-?
You can request a quote for Guanidine, 1-tert-butyl-2-cyano-3-(2-pyridylethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Guanidine, 1-tert-butyl-2-cyano-3-(2-pyridylethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Guanidine, 1-tert-butyl-2-cyano-3-(2-pyridylethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.