Sulfuric acid--2-(methylamino)ethyl carbamimidothioate (1/1)
TL;DR: Sulfuric acid--2-(methylamino)ethyl carbamimidothioate (1/1) (CAS 64039-35-6) is a chemical compound with molecular formula C4H13N3O4S2 and molecular weight 231.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(methylamino)ethyl carbamimidothioate;sulfuric acid
Also Known As: N-Methylaminoethyl isothiouronium sulfate, 2-(methylamino)ethyl carbamimidothioate sulfate(1:1), 2-(methylamino)ethyl carbamimidothioate; sulfuric acid, Pseudourea, 2-(2-methylaminoethyl)-2-thio-, hydrogen sulfate, Sulfuric acid--2-(methylamino)ethyl carbamimidothioate (1/1)
| Molecular Formula | C4H13N3O4S2 |
|---|---|
| Molecular Weight | 231.03 g/mol |
| LogP | -0.82 |
| Topological Polar Surface Area | 170.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 231.03474 |
| Heavy Atoms | 13 |
| Complexity | 155.0 |
Chemical Identifiers
| CAS Number | 64039-35-6 |
|---|---|
| SMILES | CNCCSC(=N)N.OS(=O)(=O)O |
| InChIKey | RXEBASZPSASLEQ-UHFFFAOYSA-N |
Product Overview
Sulfuric acid--2-(methylamino)ethyl carbamimidothioate (1/1) (CAS 64039-35-6), with molecular formula C4H13N3O4S2 and molecular weight 231.03 g/mol. IUPAC: 2-(methylamino)ethyl carbamimidothioate;sulfuric acid.
Chemical Property Profile of Sulfuric acid--2-(methylamino)ethyl carbamimidothioate (1/1)
Property Insights of Sulfuric acid--2-(methylamino)ethyl carbamimidothioate (1/1)
The XLogP value of -0.82 indicates that Sulfuric acid--2-(methylamino)ethyl carbamimidothioate (1/1) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 170.0 Ų indicates high polarity, suggesting Sulfuric acid--2-(methylamino)ethyl carbamimidothioate (1/1) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Sulfuric acid--2-(methylamino)ethyl carbamimidothioate (1/1) has 5 hydrogen bond donor(s) and 7 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 Sulfuric acid--2-(methylamino)ethyl carbamimidothioate (1/1)?
The CAS number of Sulfuric acid--2-(methylamino)ethyl carbamimidothioate (1/1) is 64039-35-6.
What is the molecular formula of Sulfuric acid--2-(methylamino)ethyl carbamimidothioate (1/1)?
The molecular formula of Sulfuric acid--2-(methylamino)ethyl carbamimidothioate (1/1) is C4H13N3O4S2.
What is the molecular weight of Sulfuric acid--2-(methylamino)ethyl carbamimidothioate (1/1)?
The molecular weight of Sulfuric acid--2-(methylamino)ethyl carbamimidothioate (1/1) is 231.03 g/mol.
Where can I buy Sulfuric acid--2-(methylamino)ethyl carbamimidothioate (1/1)?
You can request a quote for Sulfuric acid--2-(methylamino)ethyl carbamimidothioate (1/1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Sulfuric acid--2-(methylamino)ethyl carbamimidothioate (1/1)?
Yes, KEHONG BIO provides custom synthesis services for Sulfuric acid--2-(methylamino)ethyl carbamimidothioate (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.