Monofluoromethylagmatine
TL;DR: Monofluoromethylagmatine (CAS 107240-29-9) is a chemical compound with molecular formula C(CC(CF)N)CN=C(N)N and molecular weight 162.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-amino-5-fluoropentyl)guanidine
Also Known As: Fluoromethylagmatine, Monofluoromethylagmatine, 2-(4-amino-5-fluoropentyl)guanidine, alpha-monofluoromethylagmatine, Guanidine,N-(4-amino-5-fluoropentyl)-
| Molecular Formula | C(CC(CF)N)CN=C(N)N |
|---|---|
| Molecular Weight | 162.13 g/mol |
| LogP | -1.1 |
| Topological Polar Surface Area | 90.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 162.12808 |
| Heavy Atoms | 11 |
| Complexity | 122.0 |
Chemical Identifiers
| CAS Number | 107240-29-9 |
|---|---|
| SMILES | C(CC(CF)N)CN=C(N)N |
| InChIKey | SUJCPTTWZVYXRT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Monofluoromethylagmatine (CAS 107240-29-9), with molecular formula C(CC(CF)N)CN=C(N)N and molecular weight 162.13 g/mol. IUPAC: 2-(4-amino-5-fluoropentyl)guanidine.
Chemical Property Profile of Monofluoromethylagmatine
Property Insights of Monofluoromethylagmatine
The XLogP value of -1.1 indicates that Monofluoromethylagmatine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 90.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Monofluoromethylagmatine. Following Lipinski's Rule of Five, Monofluoromethylagmatine has 3 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 Monofluoromethylagmatine?
The CAS number of Monofluoromethylagmatine is 107240-29-9.
What is the molecular formula of Monofluoromethylagmatine?
The molecular formula of Monofluoromethylagmatine is C(CC(CF)N)CN=C(N)N.
What is the molecular weight of Monofluoromethylagmatine?
The molecular weight of Monofluoromethylagmatine is 162.13 g/mol.
Where can I buy Monofluoromethylagmatine?
You can request a quote for Monofluoromethylagmatine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Monofluoromethylagmatine?
Yes, KEHONG BIO provides custom synthesis services for Monofluoromethylagmatine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.