2-Benzyl-1-cyanoguanidine
TL;DR: 2-Benzyl-1-cyanoguanidine (CAS 93070-49-6) 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.
2-benzyl-1-cyanoguanidine
Also Known As: 2-benzyl-1-cyanoguanidine, 3-benzyl-1-cyanoguanidine, 1-Benzyl-2-cyanoguanidine, N-Benzyl-N'-cyanoguanidine, 1-benzyl-2-cyano-guanidine
| Molecular Formula | C9H10N4 |
|---|---|
| Molecular Weight | 174.09 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 74.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 174.09055 |
| Heavy Atoms | 13 |
| Complexity | 219.0 |
Chemical Identifiers
| CAS Number | 93070-49-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN=C(N)NC#N |
| InChIKey | VFDXJSPBOJYHQF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Benzyl-1-cyanoguanidine (CAS 93070-49-6), with molecular formula C9H10N4 and molecular weight 174.09 g/mol. IUPAC: 2-benzyl-1-cyanoguanidine.
Chemical Property Profile of 2-Benzyl-1-cyanoguanidine
Property Insights of 2-Benzyl-1-cyanoguanidine
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Benzyl-1-cyanoguanidine. The TPSA of 74.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Benzyl-1-cyanoguanidine. Following Lipinski's Rule of Five, 2-Benzyl-1-cyanoguanidine 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 2-Benzyl-1-cyanoguanidine?
The CAS number of 2-Benzyl-1-cyanoguanidine is 93070-49-6.
What is the molecular formula of 2-Benzyl-1-cyanoguanidine?
The molecular formula of 2-Benzyl-1-cyanoguanidine is C9H10N4.
What is the molecular weight of 2-Benzyl-1-cyanoguanidine?
The molecular weight of 2-Benzyl-1-cyanoguanidine is 174.09 g/mol.
Where can I buy 2-Benzyl-1-cyanoguanidine?
You can request a quote for 2-Benzyl-1-cyanoguanidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Benzyl-1-cyanoguanidine?
Yes, KEHONG BIO provides custom synthesis services for 2-Benzyl-1-cyanoguanidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.