N-(4-butylphenyl)guanidine
TL;DR: N-(4-butylphenyl)guanidine (CAS 162254-59-3) is a chemical compound with molecular formula C11H17N3 and molecular weight 191.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-butylphenyl)guanidine
Also Known As: N-(4-butylphenyl)guanidine, 1-(4-butylphenyl)guanidine, p-n-Butylphenylguanidin, 2-(4-butylphenyl)guanidine, NCI60_030842
| Molecular Formula | C11H17N3 |
|---|---|
| Molecular Weight | 191.14 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 64.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 191.14224 |
| Heavy Atoms | 14 |
| Complexity | 177.0 |
Chemical Identifiers
| CAS Number | 162254-59-3 |
|---|---|
| SMILES | CCCCC1=CC=C(C=C1)N=C(N)N |
| InChIKey | IIRIDIBAVSYTKC-UHFFFAOYSA-N |
Product Overview
N-(4-butylphenyl)guanidine (CAS 162254-59-3), with molecular formula C11H17N3 and molecular weight 191.14 g/mol. IUPAC: 2-(4-butylphenyl)guanidine.
Chemical Property Profile of N-(4-butylphenyl)guanidine
Property Insights of N-(4-butylphenyl)guanidine
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-butylphenyl)guanidine. The TPSA of 64.4 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-butylphenyl)guanidine. Following Lipinski's Rule of Five, N-(4-butylphenyl)guanidine has 2 hydrogen bond donor(s) and 1 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 N-(4-butylphenyl)guanidine?
The CAS number of N-(4-butylphenyl)guanidine is 162254-59-3.
What is the molecular formula of N-(4-butylphenyl)guanidine?
The molecular formula of N-(4-butylphenyl)guanidine is C11H17N3.
What is the molecular weight of N-(4-butylphenyl)guanidine?
The molecular weight of N-(4-butylphenyl)guanidine is 191.14 g/mol.
Where can I buy N-(4-butylphenyl)guanidine?
You can request a quote for N-(4-butylphenyl)guanidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-butylphenyl)guanidine?
Yes, KEHONG BIO provides custom synthesis services for N-(4-butylphenyl)guanidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.