N-(4,6-dimethylpyrimidin-2-yl)-N'-(4-fluorophenyl)guanidine
TL;DR: N-(4,6-dimethylpyrimidin-2-yl)-N'-(4-fluorophenyl)guanidine (CAS 16018-65-8) is a chemical compound with molecular formula C13H14FN5 and molecular weight 259.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4,6-dimethylpyrimidin-2-yl)-1-(4-fluorophenyl)guanidine
Also Known As: N-(4,6-dimethylpyrimidin-2-yl)-N'-(4-fluorophenyl)guanidine, 1-(4,6-dimethylpyrimidin-2-yl)-3-(4-fluorophenyl)guanidine, 2-(4,6-dimethylpyrimidin-2-yl)-1-(4-fluorophenyl)guanidine, 1-(4,6-Dimethyl-2-Pyrimidinyl)-3-(4-Fluorophenyl)Guanidine, 1-(4,6-Dimethyl-2-pyrimidinyl)-3-(p-fluorophenyl)guanidine
| Molecular Formula | C13H14FN5 |
|---|---|
| Molecular Weight | 259.12 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 76.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 259.12332 |
| Heavy Atoms | 19 |
| Complexity | 304.0 |
Chemical Identifiers
| CAS Number | 16018-65-8 |
|---|---|
| SMILES | CC1=CC(=NC(=N1)N=C(N)NC2=CC=C(C=C2)F)C |
| InChIKey | HXOLTKGSYIFEBZ-UHFFFAOYSA-N |
Product Overview
N-(4,6-dimethylpyrimidin-2-yl)-N'-(4-fluorophenyl)guanidine (CAS 16018-65-8), with molecular formula C13H14FN5 and molecular weight 259.12 g/mol. IUPAC: 2-(4,6-dimethylpyrimidin-2-yl)-1-(4-fluorophenyl)guanidine.
Chemical Property Profile of N-(4,6-dimethylpyrimidin-2-yl)-N'-(4-fluorophenyl)guanidine
Property Insights of N-(4,6-dimethylpyrimidin-2-yl)-N'-(4-fluorophenyl)guanidine
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4,6-dimethylpyrimidin-2-yl)-N'-(4-fluorophenyl)guanidine. The TPSA of 76.2 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4,6-dimethylpyrimidin-2-yl)-N'-(4-fluorophenyl)guanidine. Following Lipinski's Rule of Five, N-(4,6-dimethylpyrimidin-2-yl)-N'-(4-fluorophenyl)guanidine has 2 hydrogen bond donor(s) and 4 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-(4,6-dimethylpyrimidin-2-yl)-N'-(4-fluorophenyl)guanidine?
The CAS number of N-(4,6-dimethylpyrimidin-2-yl)-N'-(4-fluorophenyl)guanidine is 16018-65-8.
What is the molecular formula of N-(4,6-dimethylpyrimidin-2-yl)-N'-(4-fluorophenyl)guanidine?
The molecular formula of N-(4,6-dimethylpyrimidin-2-yl)-N'-(4-fluorophenyl)guanidine is C13H14FN5.
What is the molecular weight of N-(4,6-dimethylpyrimidin-2-yl)-N'-(4-fluorophenyl)guanidine?
The molecular weight of N-(4,6-dimethylpyrimidin-2-yl)-N'-(4-fluorophenyl)guanidine is 259.12 g/mol.
Where can I buy N-(4,6-dimethylpyrimidin-2-yl)-N'-(4-fluorophenyl)guanidine?
You can request a quote for N-(4,6-dimethylpyrimidin-2-yl)-N'-(4-fluorophenyl)guanidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4,6-dimethylpyrimidin-2-yl)-N'-(4-fluorophenyl)guanidine?
Yes, KEHONG BIO provides custom synthesis services for N-(4,6-dimethylpyrimidin-2-yl)-N'-(4-fluorophenyl)guanidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.