N-(3-chlorophenyl)-N'-(4,6-dimethylpyrimidin-2-yl)guanidine
TL;DR: N-(3-chlorophenyl)-N'-(4,6-dimethylpyrimidin-2-yl)guanidine (CAS 332073-82-2) is a chemical compound with molecular formula C13H14ClN5 and molecular weight 275.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-chlorophenyl)-2-(4,6-dimethylpyrimidin-2-yl)guanidine
Also Known As: N-(3-chlorophenyl)-N'-(4,6-dimethylpyrimidin-2-yl)guanidine, BAS 00916139, 1-(3-chlorophenyl)-3-(4,6-dimethylpyrimidin-2-yl)guanidine, 1-(3-chlorophenyl)-2-(4,6-dimethylpyrimidin-2-yl)guanidine
| Molecular Formula | C13H14ClN5 |
|---|---|
| Molecular Weight | 275.09 g/mol |
| LogP | 2.80514 |
| Topological Polar Surface Area | 76.19 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 275.09378 |
| Heavy Atoms | 19 |
| Complexity | 603.93066 |
Chemical Identifiers
| CAS Number | 332073-82-2 |
|---|---|
| SMILES | CC1=CC(=NC(=N1)N=C(N)NC2=CC(=CC=C2)Cl)C |
Product Overview
N-(3-chlorophenyl)-N'-(4,6-dimethylpyrimidin-2-yl)guanidine (CAS 332073-82-2), with molecular formula C13H14ClN5 and molecular weight 275.09 g/mol. IUPAC: 1-(3-chlorophenyl)-2-(4,6-dimethylpyrimidin-2-yl)guanidine.
Chemical Property Profile of N-(3-chlorophenyl)-N'-(4,6-dimethylpyrimidin-2-yl)guanidine
Property Insights of N-(3-chlorophenyl)-N'-(4,6-dimethylpyrimidin-2-yl)guanidine
The XLogP value of 2.80514 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-chlorophenyl)-N'-(4,6-dimethylpyrimidin-2-yl)guanidine. The TPSA of 76.19 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-chlorophenyl)-N'-(4,6-dimethylpyrimidin-2-yl)guanidine. Following Lipinski's Rule of Five, N-(3-chlorophenyl)-N'-(4,6-dimethylpyrimidin-2-yl)guanidine has 2 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 N-(3-chlorophenyl)-N'-(4,6-dimethylpyrimidin-2-yl)guanidine?
The CAS number of N-(3-chlorophenyl)-N'-(4,6-dimethylpyrimidin-2-yl)guanidine is 332073-82-2.
What is the molecular formula of N-(3-chlorophenyl)-N'-(4,6-dimethylpyrimidin-2-yl)guanidine?
The molecular formula of N-(3-chlorophenyl)-N'-(4,6-dimethylpyrimidin-2-yl)guanidine is C13H14ClN5.
What is the molecular weight of N-(3-chlorophenyl)-N'-(4,6-dimethylpyrimidin-2-yl)guanidine?
The molecular weight of N-(3-chlorophenyl)-N'-(4,6-dimethylpyrimidin-2-yl)guanidine is 275.09 g/mol.
Where can I buy N-(3-chlorophenyl)-N'-(4,6-dimethylpyrimidin-2-yl)guanidine?
You can request a quote for N-(3-chlorophenyl)-N'-(4,6-dimethylpyrimidin-2-yl)guanidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-chlorophenyl)-N'-(4,6-dimethylpyrimidin-2-yl)guanidine?
Yes, KEHONG BIO provides custom synthesis services for N-(3-chlorophenyl)-N'-(4,6-dimethylpyrimidin-2-yl)guanidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.