精胺胍
TL;DR: 精胺胍 (CAS 544-05-8) is a chemical compound with molecular formula C6H16N6 and molecular weight 172.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
精胺胍
2-[4-(diaminomethylideneamino)butyl]guanidine
Also Known As: arcaine, 1,4-Diguanidinobutane, Arcaine sulfate, Tetramethylenediguanide, Arcain
| Molecular Formula | C6H16N6 |
|---|---|
| Molecular Weight | 172.14 g/mol |
| LogP | -2.2 |
| Topological Polar Surface Area | 129.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 172.14365 |
| Heavy Atoms | 12 |
| Complexity | 145.0 |
Chemical Identifiers
| CAS Number | 544-05-8 |
|---|---|
| SMILES | C(CCN=C(N)N)CN=C(N)N |
| InChIKey | HGMDNMBBCKDWTQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
精胺胍 (CAS 544-05-8), with molecular formula C6H16N6 and molecular weight 172.14 g/mol. IUPAC: 2-[4-(diaminomethylideneamino)butyl]guanidine.
Chemical Property Profile of 精胺胍
Property Insights of 精胺胍
The XLogP value of -2.2 indicates that 精胺胍 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 129.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 精胺胍. Following Lipinski's Rule of Five, 精胺胍 has 4 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 精胺胍?
The CAS number of 精胺胍 is 544-05-8.
What is the molecular formula of 精胺胍?
The molecular formula of 精胺胍 is C6H16N6.
What is the molecular weight of 精胺胍?
The molecular weight of 精胺胍 is 172.14 g/mol.
Where can I buy 精胺胍?
You can request a quote for 精胺胍 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 精胺胍?
Yes, KEHONG BIO provides custom synthesis services for 精胺胍 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.