1-Allyl-biguanid
TL;DR: 1-Allyl-biguanid (CAS 98137-84-9) is a chemical compound with molecular formula C5H11N5 and molecular weight 141.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(diaminomethylidene)-2-prop-2-enylguanidine
Also Known As: 1-allyl-biguanide, 1-allylbiguanide, 1-Allyl-biguanid, J1.278.850I, 1-(diaminomethylidene)-2-prop-2-enylguanidine
| Molecular Formula | C5H11N5 |
|---|---|
| Molecular Weight | 141.10 g/mol |
| LogP | -1.2395 |
| Topological Polar Surface Area | 102.78 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 141.10144 |
| Heavy Atoms | 10 |
| Complexity | 164.87712 |
Chemical Identifiers
| CAS Number | 98137-84-9 |
|---|---|
| SMILES | C=CCN=C(N)N=C(N)N |
Product Overview
1-Allyl-biguanid (CAS 98137-84-9), with molecular formula C5H11N5 and molecular weight 141.10 g/mol. IUPAC: 1-(diaminomethylidene)-2-prop-2-enylguanidine.
Chemical Property Profile of 1-Allyl-biguanid
Property Insights of 1-Allyl-biguanid
The XLogP value of -1.2395 indicates that 1-Allyl-biguanid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 102.78 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Allyl-biguanid. Following Lipinski's Rule of Five, 1-Allyl-biguanid has 3 hydrogen bond donor(s) and 1 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 1-Allyl-biguanid?
The CAS number of 1-Allyl-biguanid is 98137-84-9.
What is the molecular formula of 1-Allyl-biguanid?
The molecular formula of 1-Allyl-biguanid is C5H11N5.
What is the molecular weight of 1-Allyl-biguanid?
The molecular weight of 1-Allyl-biguanid is 141.10 g/mol.
Where can I buy 1-Allyl-biguanid?
You can request a quote for 1-Allyl-biguanid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Allyl-biguanid?
Yes, KEHONG BIO provides custom synthesis services for 1-Allyl-biguanid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.