N-Cyano-N'-(2-methylphenyl)guanidine
TL;DR: N-Cyano-N'-(2-methylphenyl)guanidine (CAS 76247-37-5) is a chemical compound with molecular formula C9H10N4 and molecular weight 174.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-cyano-2-(2-methylphenyl)guanidine
Also Known As: 1-cyano-3-(o-tolyl)guanidine, N-Cyano-N'-(2-methylphenyl)guanidine, N''-cyano-N-(2-methylphenyl)guanidine, 1-cyano-2-(2-methylphenyl)guanidine, NCI60_024553
| Molecular Formula | C9H10N4 |
|---|---|
| Molecular Weight | 174.09 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 74.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 174.09055 |
| Heavy Atoms | 13 |
| Complexity | 237.0 |
Chemical Identifiers
| CAS Number | 76247-37-5 |
|---|---|
| SMILES | CC1=CC=CC=C1N=C(N)NC#N |
| InChIKey | YSDZQAQCSRAWSK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-Cyano-N'-(2-methylphenyl)guanidine (CAS 76247-37-5), with molecular formula C9H10N4 and molecular weight 174.09 g/mol. IUPAC: 1-cyano-2-(2-methylphenyl)guanidine.
Chemical Property Profile of N-Cyano-N'-(2-methylphenyl)guanidine
Property Insights of N-Cyano-N'-(2-methylphenyl)guanidine
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Cyano-N'-(2-methylphenyl)guanidine. The TPSA of 74.2 Ų falls within the moderate polarity range, balancing permeability and solubility for N-Cyano-N'-(2-methylphenyl)guanidine. Following Lipinski's Rule of Five, N-Cyano-N'-(2-methylphenyl)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-Cyano-N'-(2-methylphenyl)guanidine?
The CAS number of N-Cyano-N'-(2-methylphenyl)guanidine is 76247-37-5.
What is the molecular formula of N-Cyano-N'-(2-methylphenyl)guanidine?
The molecular formula of N-Cyano-N'-(2-methylphenyl)guanidine is C9H10N4.
What is the molecular weight of N-Cyano-N'-(2-methylphenyl)guanidine?
The molecular weight of N-Cyano-N'-(2-methylphenyl)guanidine is 174.09 g/mol.
Where can I buy N-Cyano-N'-(2-methylphenyl)guanidine?
You can request a quote for N-Cyano-N'-(2-methylphenyl)guanidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Cyano-N'-(2-methylphenyl)guanidine?
Yes, KEHONG BIO provides custom synthesis services for N-Cyano-N'-(2-methylphenyl)guanidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.