Veratrylguanidine methane sulfonate
TL;DR: Veratrylguanidine methane sulfonate (CAS 1780-28-5) is a chemical compound with molecular formula C11H19N3O5S and molecular weight 305.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3,4-dimethoxyphenyl)methyl]guanidine;methanesulfonic acid
Also Known As: Msvguanidine, Veratrylguanidine methane sulfonate, veratrylguanidine methanesulfonate, veratrylguanidinemethanesulfonate, 2-(3,4-dimethoxybenzyl)guanidine methanesulfonate(1:1)
| Molecular Formula | C11H19N3O5S |
|---|---|
| Molecular Weight | 305.10 g/mol |
| LogP | -0.0188 |
| Topological Polar Surface Area | 146.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 305.10455 |
| Heavy Atoms | 20 |
| Complexity | 309.0 |
Chemical Identifiers
| CAS Number | 1780-28-5 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CN=C(N)N)OC.CS(=O)(=O)O |
| InChIKey | LMNTYSMXUXRWGD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Veratrylguanidine methane sulfonate (CAS 1780-28-5), with molecular formula C11H19N3O5S and molecular weight 305.10 g/mol. IUPAC: 2-[(3,4-dimethoxyphenyl)methyl]guanidine;methanesulfonic acid.
Chemical Property Profile of Veratrylguanidine methane sulfonate
Property Insights of Veratrylguanidine methane sulfonate
The XLogP value of -0.0188 indicates that Veratrylguanidine methane sulfonate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 146.0 Ų indicates high polarity, suggesting Veratrylguanidine methane sulfonate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Veratrylguanidine methane sulfonate has 3 hydrogen bond donor(s) and 6 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 Veratrylguanidine methane sulfonate?
The CAS number of Veratrylguanidine methane sulfonate is 1780-28-5.
What is the molecular formula of Veratrylguanidine methane sulfonate?
The molecular formula of Veratrylguanidine methane sulfonate is C11H19N3O5S.
What is the molecular weight of Veratrylguanidine methane sulfonate?
The molecular weight of Veratrylguanidine methane sulfonate is 305.10 g/mol.
Where can I buy Veratrylguanidine methane sulfonate?
You can request a quote for Veratrylguanidine methane sulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Veratrylguanidine methane sulfonate?
Yes, KEHONG BIO provides custom synthesis services for Veratrylguanidine methane sulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.