2-(N-(2-ethylhexyl)carbamimidoyl)-1-(4-methylphenyl)guanidine
TL;DR: 2-(N-(2-ethylhexyl)carbamimidoyl)-1-(4-methylphenyl)guanidine (CAS 69232-07-1) is a chemical compound with molecular formula C17H29N5 and molecular weight 303.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[amino-(4-methylanilino)methylidene]-2-(2-ethylhexyl)guanidine
Also Known As: 2-(N-(2-ethylhexyl)carbamimidoyl)-1-(4-methylphenyl)guanidine, 1-[amino-(4-methylanilino)methylidene]-2-(2-ethylhexyl)guanidine, N-[(E)-Amino(4-methylanilino)methylidene]-N''-(2-ethylhexyl)guanidine
| Molecular Formula | C17H29N5 |
|---|---|
| Molecular Weight | 303.24 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 88.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 9 |
| Exact Mass | 303.2423 |
| Heavy Atoms | 22 |
| Complexity | 356.0 |
Chemical Identifiers
| CAS Number | 69232-07-1 |
|---|---|
| SMILES | CCCCC(CC)CN=C(N)N=C(N)NC1=CC=C(C=C1)C |
| InChIKey | IYVTWEWYYAYKEF-UHFFFAOYSA-N |
Product Overview
2-(N-(2-ethylhexyl)carbamimidoyl)-1-(4-methylphenyl)guanidine (CAS 69232-07-1), with molecular formula C17H29N5 and molecular weight 303.24 g/mol. IUPAC: 1-[amino-(4-methylanilino)methylidene]-2-(2-ethylhexyl)guanidine.
Chemical Property Profile of 2-(N-(2-ethylhexyl)carbamimidoyl)-1-(4-methylphenyl)guanidine
Property Insights of 2-(N-(2-ethylhexyl)carbamimidoyl)-1-(4-methylphenyl)guanidine
The XLogP value of 3.6 indicates that 2-(N-(2-ethylhexyl)carbamimidoyl)-1-(4-methylphenyl)guanidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(N-(2-ethylhexyl)carbamimidoyl)-1-(4-methylphenyl)guanidine. Following Lipinski's Rule of Five, 2-(N-(2-ethylhexyl)carbamimidoyl)-1-(4-methylphenyl)guanidine has 3 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 2-(N-(2-ethylhexyl)carbamimidoyl)-1-(4-methylphenyl)guanidine?
The CAS number of 2-(N-(2-ethylhexyl)carbamimidoyl)-1-(4-methylphenyl)guanidine is 69232-07-1.
What is the molecular formula of 2-(N-(2-ethylhexyl)carbamimidoyl)-1-(4-methylphenyl)guanidine?
The molecular formula of 2-(N-(2-ethylhexyl)carbamimidoyl)-1-(4-methylphenyl)guanidine is C17H29N5.
What is the molecular weight of 2-(N-(2-ethylhexyl)carbamimidoyl)-1-(4-methylphenyl)guanidine?
The molecular weight of 2-(N-(2-ethylhexyl)carbamimidoyl)-1-(4-methylphenyl)guanidine is 303.24 g/mol.
Where can I buy 2-(N-(2-ethylhexyl)carbamimidoyl)-1-(4-methylphenyl)guanidine?
You can request a quote for 2-(N-(2-ethylhexyl)carbamimidoyl)-1-(4-methylphenyl)guanidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(N-(2-ethylhexyl)carbamimidoyl)-1-(4-methylphenyl)guanidine?
Yes, KEHONG BIO provides custom synthesis services for 2-(N-(2-ethylhexyl)carbamimidoyl)-1-(4-methylphenyl)guanidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.