1-(2,6-Xylyl)biguanide
TL;DR: 1-(2,6-Xylyl)biguanide (CAS 29213-16-9) is a chemical compound with molecular formula C10H15N5 and molecular weight 205.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(diaminomethylidene)-2-(2,6-dimethylphenyl)guanidine
Also Known As: 1-(2,6-Xylyl)biguanide, 1- biguanide, Maybridge1_005872, diisopropyldiazodicarboxylate, N-(diaminomethylene)-N'-(2,6-dimethylphenyl)guanidine
| Molecular Formula | C10H15N5 |
|---|---|
| Molecular Weight | 205.13 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 103.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 205.13275 |
| Heavy Atoms | 15 |
| Complexity | 257.0 |
Chemical Identifiers
| CAS Number | 29213-16-9 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)C)N=C(N)N=C(N)N |
| InChIKey | HPDCRAOWFOIELP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(2,6-Xylyl)biguanide (CAS 29213-16-9), with molecular formula C10H15N5 and molecular weight 205.13 g/mol. IUPAC: 1-(diaminomethylidene)-2-(2,6-dimethylphenyl)guanidine.
Chemical Property Profile of 1-(2,6-Xylyl)biguanide
Property Insights of 1-(2,6-Xylyl)biguanide
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2,6-Xylyl)biguanide. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2,6-Xylyl)biguanide. Following Lipinski's Rule of Five, 1-(2,6-Xylyl)biguanide 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-(2,6-Xylyl)biguanide?
The CAS number of 1-(2,6-Xylyl)biguanide is 29213-16-9.
What is the molecular formula of 1-(2,6-Xylyl)biguanide?
The molecular formula of 1-(2,6-Xylyl)biguanide is C10H15N5.
What is the molecular weight of 1-(2,6-Xylyl)biguanide?
The molecular weight of 1-(2,6-Xylyl)biguanide is 205.13 g/mol.
Where can I buy 1-(2,6-Xylyl)biguanide?
You can request a quote for 1-(2,6-Xylyl)biguanide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2,6-Xylyl)biguanide?
Yes, KEHONG BIO provides custom synthesis services for 1-(2,6-Xylyl)biguanide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.