N-(3-Methoxy-benzyl)-guanidine
TL;DR: N-(3-Methoxy-benzyl)-guanidine (CAS 46228-51-7) is a chemical compound with molecular formula C9H13N3O and molecular weight 179.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3-methoxyphenyl)methyl]guanidine
Also Known As: 1-(3-Methoxybenzyl)guanidine, N-(3-Methoxy-benzyl)-guanidine, n-(3-methoxybenzyl)guanidine, 2-[(3-methoxyphenyl)methyl]guanidine, 3,4-Dichlor-benzylguanidin
| Molecular Formula | C9H13N3O |
|---|---|
| Molecular Weight | 179.11 g/mol |
| LogP | 0.4686 |
| Topological Polar Surface Area | 73.63 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 179.10587 |
| Heavy Atoms | 13 |
| Complexity | 305.48306 |
Chemical Identifiers
| CAS Number | 46228-51-7 |
|---|---|
| SMILES | COC1=CC=CC(=C1)CN=C(N)N |
Product Overview
N-(3-Methoxy-benzyl)-guanidine (CAS 46228-51-7), with molecular formula C9H13N3O and molecular weight 179.11 g/mol. IUPAC: 2-[(3-methoxyphenyl)methyl]guanidine.
Chemical Property Profile of N-(3-Methoxy-benzyl)-guanidine
Property Insights of N-(3-Methoxy-benzyl)-guanidine
The XLogP value of 0.4686 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-Methoxy-benzyl)-guanidine. The TPSA of 73.63 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-Methoxy-benzyl)-guanidine. Following Lipinski's Rule of Five, N-(3-Methoxy-benzyl)-guanidine has 2 hydrogen bond donor(s) and 2 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-Methoxy-benzyl)-guanidine?
The CAS number of N-(3-Methoxy-benzyl)-guanidine is 46228-51-7.
What is the molecular formula of N-(3-Methoxy-benzyl)-guanidine?
The molecular formula of N-(3-Methoxy-benzyl)-guanidine is C9H13N3O.
What is the molecular weight of N-(3-Methoxy-benzyl)-guanidine?
The molecular weight of N-(3-Methoxy-benzyl)-guanidine is 179.11 g/mol.
Where can I buy N-(3-Methoxy-benzyl)-guanidine?
You can request a quote for N-(3-Methoxy-benzyl)-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-Methoxy-benzyl)-guanidine?
Yes, KEHONG BIO provides custom synthesis services for N-(3-Methoxy-benzyl)-guanidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.