Guanidine, 2-cyano-1-tert-pentyl-3-(2,6-xylyl)-
TL;DR: Guanidine, 2-cyano-1-tert-pentyl-3-(2,6-xylyl)- (CAS 67026-95-3) is a chemical compound with molecular formula C15H22N4 and molecular weight 258.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-cyano-3-(2,6-dimethylphenyl)-2-(2-methylbutan-2-yl)guanidine
Also Known As: 2-Cyano-1-tert-pentyl-3-(2,6-xylyl)guanidine, Guanidine, 2-cyano-1-tert-pentyl-3-(2,6-xylyl)-, Guanidine, N-cyano-N'-(2,6-dimethylphenyl)-N''-(1,1-dimethylpropyl)-, 1-cyano-3-(2,6-dimethylphenyl)-2-(2-methylbutan-2-yl)guanidine, N-Cyano-N'-(2,6-dimethylphenyl)-N''-(2-methylbutan-2-yl)guanidine
| Molecular Formula | C15H22N4 |
|---|---|
| Molecular Weight | 258.18 g/mol |
| LogP | 3.33062 |
| Topological Polar Surface Area | 60.21 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 258.18445 |
| Heavy Atoms | 19 |
| Complexity | 489.11713 |
Chemical Identifiers
| CAS Number | 67026-95-3 |
|---|---|
| SMILES | CCC(C)(C)N=C(NC#N)NC1=C(C=CC=C1C)C |
Product Overview
Guanidine, 2-cyano-1-tert-pentyl-3-(2,6-xylyl)- (CAS 67026-95-3), with molecular formula C15H22N4 and molecular weight 258.18 g/mol. IUPAC: 1-cyano-3-(2,6-dimethylphenyl)-2-(2-methylbutan-2-yl)guanidine.
Chemical Property Profile of Guanidine, 2-cyano-1-tert-pentyl-3-(2,6-xylyl)-
Property Insights of Guanidine, 2-cyano-1-tert-pentyl-3-(2,6-xylyl)-
The XLogP value of 3.33062 indicates that Guanidine, 2-cyano-1-tert-pentyl-3-(2,6-xylyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.21 Ų falls within the moderate polarity range, balancing permeability and solubility for Guanidine, 2-cyano-1-tert-pentyl-3-(2,6-xylyl)-. Following Lipinski's Rule of Five, Guanidine, 2-cyano-1-tert-pentyl-3-(2,6-xylyl)- has 2 hydrogen bond donor(s) and 2 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-tert-pentyl-3-(2,6-xylyl)-?
The CAS number of Guanidine, 2-cyano-1-tert-pentyl-3-(2,6-xylyl)- is 67026-95-3.
What is the molecular formula of Guanidine, 2-cyano-1-tert-pentyl-3-(2,6-xylyl)-?
The molecular formula of Guanidine, 2-cyano-1-tert-pentyl-3-(2,6-xylyl)- is C15H22N4.
What is the molecular weight of Guanidine, 2-cyano-1-tert-pentyl-3-(2,6-xylyl)-?
The molecular weight of Guanidine, 2-cyano-1-tert-pentyl-3-(2,6-xylyl)- is 258.18 g/mol.
Where can I buy Guanidine, 2-cyano-1-tert-pentyl-3-(2,6-xylyl)-?
You can request a quote for Guanidine, 2-cyano-1-tert-pentyl-3-(2,6-xylyl)- 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-tert-pentyl-3-(2,6-xylyl)-?
Yes, KEHONG BIO provides custom synthesis services for Guanidine, 2-cyano-1-tert-pentyl-3-(2,6-xylyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.