S-(2-Ethylguanidine)phosphorothioic acid
TL;DR: S-(2-Ethylguanidine)phosphorothioic acid (CAS 6335-79-1) is a chemical compound with molecular formula C3H10N3O3PS and molecular weight 199.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(diaminomethylideneamino)ethylsulfanylphosphonic acid
Also Known As: S-(2-Ethylguanidine)phosphorothioic acid, Guanidine, (2-(phosphonothio)ethyl)-, 2-(diaminomethylideneamino)ethylsulfanylphosphonic acid, s-{2-[(diaminomethylidene)amino]ethyl} dihydrogen phosphorothioate, Thiophosphorsaeure-S-<2-diaminomethylamino-ethylester>S-(2-Ethylguanidine)phosphorothioic acid
| Molecular Formula | C3H10N3O3PS |
|---|---|
| Molecular Weight | 199.02 g/mol |
| LogP | -2.7 |
| Topological Polar Surface Area | 147.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 199.01805 |
| Heavy Atoms | 11 |
| Complexity | 186.0 |
Chemical Identifiers
| CAS Number | 6335-79-1 |
|---|---|
| SMILES | C(CSP(=O)(O)O)N=C(N)N |
| InChIKey | BRRDYVDAJREXSQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
S-(2-Ethylguanidine)phosphorothioic acid (CAS 6335-79-1), with molecular formula C3H10N3O3PS and molecular weight 199.02 g/mol. IUPAC: 2-(diaminomethylideneamino)ethylsulfanylphosphonic acid.
Chemical Property Profile of S-(2-Ethylguanidine)phosphorothioic acid
Property Insights of S-(2-Ethylguanidine)phosphorothioic acid
The XLogP value of -2.7 indicates that S-(2-Ethylguanidine)phosphorothioic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 147.0 Ų indicates high polarity, suggesting S-(2-Ethylguanidine)phosphorothioic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, S-(2-Ethylguanidine)phosphorothioic acid has 4 hydrogen bond donor(s) and 5 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 S-(2-Ethylguanidine)phosphorothioic acid?
The CAS number of S-(2-Ethylguanidine)phosphorothioic acid is 6335-79-1.
What is the molecular formula of S-(2-Ethylguanidine)phosphorothioic acid?
The molecular formula of S-(2-Ethylguanidine)phosphorothioic acid is C3H10N3O3PS.
What is the molecular weight of S-(2-Ethylguanidine)phosphorothioic acid?
The molecular weight of S-(2-Ethylguanidine)phosphorothioic acid is 199.02 g/mol.
Where can I buy S-(2-Ethylguanidine)phosphorothioic acid?
You can request a quote for S-(2-Ethylguanidine)phosphorothioic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for S-(2-Ethylguanidine)phosphorothioic acid?
Yes, KEHONG BIO provides custom synthesis services for S-(2-Ethylguanidine)phosphorothioic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.