Guanidine, 2-cyano-1-(3-pentyl)-3-(3-pyridyl)-
TL;DR: Guanidine, 2-cyano-1-(3-pentyl)-3-(3-pyridyl)- (CAS 60560-01-2) is a chemical compound with molecular formula C12H17N5 and molecular weight 231.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-cyano-2-pentan-3-yl-3-pyridin-3-ylguanidine
Also Known As: 2-Cyano-1- -3- guanidine, 2-Cyano-1-(1-ethylpropyl)-3-(3-pyridyl)guanidine, GUANIDINE, 2-CYANO-1-(3-PENTYL)-3-(3-PYRIDYL)-, 1-cyano-2-pentan-3-yl-3-pyridin-3-ylguanidine, Guanidine, 2-cyano-1-(1-ethylpropyl)-3-(3-pyridyl)-
| Molecular Formula | C12H17N5 |
|---|---|
| Molecular Weight | 231.15 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 73.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 231.14839 |
| Heavy Atoms | 17 |
| Complexity | 287.0 |
Chemical Identifiers
| CAS Number | 60560-01-2 |
|---|---|
| SMILES | CCC(CC)N=C(NC#N)NC1=CN=CC=C1 |
| InChIKey | VUTFWRRFRIIESD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Guanidine, 2-cyano-1-(3-pentyl)-3-(3-pyridyl)- (CAS 60560-01-2), with molecular formula C12H17N5 and molecular weight 231.15 g/mol. IUPAC: 1-cyano-2-pentan-3-yl-3-pyridin-3-ylguanidine.
Chemical Property Profile of Guanidine, 2-cyano-1-(3-pentyl)-3-(3-pyridyl)-
Property Insights of Guanidine, 2-cyano-1-(3-pentyl)-3-(3-pyridyl)-
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Guanidine, 2-cyano-1-(3-pentyl)-3-(3-pyridyl)-. The TPSA of 73.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Guanidine, 2-cyano-1-(3-pentyl)-3-(3-pyridyl)-. Following Lipinski's Rule of Five, Guanidine, 2-cyano-1-(3-pentyl)-3-(3-pyridyl)- 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, 2-cyano-1-(3-pentyl)-3-(3-pyridyl)-?
The CAS number of Guanidine, 2-cyano-1-(3-pentyl)-3-(3-pyridyl)- is 60560-01-2.
What is the molecular formula of Guanidine, 2-cyano-1-(3-pentyl)-3-(3-pyridyl)-?
The molecular formula of Guanidine, 2-cyano-1-(3-pentyl)-3-(3-pyridyl)- is C12H17N5.
What is the molecular weight of Guanidine, 2-cyano-1-(3-pentyl)-3-(3-pyridyl)-?
The molecular weight of Guanidine, 2-cyano-1-(3-pentyl)-3-(3-pyridyl)- is 231.15 g/mol.
Where can I buy Guanidine, 2-cyano-1-(3-pentyl)-3-(3-pyridyl)-?
You can request a quote for Guanidine, 2-cyano-1-(3-pentyl)-3-(3-pyridyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Guanidine, 2-cyano-1-(3-pentyl)-3-(3-pyridyl)-?
Yes, KEHONG BIO provides custom synthesis services for Guanidine, 2-cyano-1-(3-pentyl)-3-(3-pyridyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.