Dihydroxy(oxo)azanium;2-(3-methylsulfanylphenyl)guanidine
TL;DR: Dihydroxy(oxo)azanium;2-(3-methylsulfanylphenyl)guanidine (CAS 71198-44-2) is a chemical compound with molecular formula C8H13N4O3S+ and molecular weight 245.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dihydroxy(oxo)azanium;2-(3-methylsulfanylphenyl)guanidine
Also Known As: dihydroxy(oxo)azanium; 2-(3-methylsulfanylphenyl)guanidine, Dihydroxy(oxo)azanium;2-(3-methylsulfanylphenyl)guanidine, DIHYDROXY-OXO-AZANIUM; 2-(3-METHYLSULFANYLPHENYL)GUANIDINE
| Molecular Formula | C8H13N4O3S+ |
|---|---|
| Molecular Weight | 245.07 g/mol |
| LogP | 0.8571 |
| Topological Polar Surface Area | 124.94 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 245.07083 |
| Heavy Atoms | 16 |
| Complexity | 375.30112 |
Chemical Identifiers
| CAS Number | 71198-44-2 |
|---|---|
| SMILES | CSC1=CC=CC(=C1)N=C(N)N.[N+](=O)(O)O |
Product Overview
Dihydroxy(oxo)azanium;2-(3-methylsulfanylphenyl)guanidine (CAS 71198-44-2), with molecular formula C8H13N4O3S+ and molecular weight 245.07 g/mol. IUPAC: dihydroxy(oxo)azanium;2-(3-methylsulfanylphenyl)guanidine.
Chemical Property Profile of Dihydroxy(oxo)azanium;2-(3-methylsulfanylphenyl)guanidine
Property Insights of Dihydroxy(oxo)azanium;2-(3-methylsulfanylphenyl)guanidine
The XLogP value of 0.8571 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dihydroxy(oxo)azanium;2-(3-methylsulfanylphenyl)guanidine. The TPSA of 124.94 Ų falls within the moderate polarity range, balancing permeability and solubility for Dihydroxy(oxo)azanium;2-(3-methylsulfanylphenyl)guanidine. Following Lipinski's Rule of Five, Dihydroxy(oxo)azanium;2-(3-methylsulfanylphenyl)guanidine has 4 hydrogen bond donor(s) and 3 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 Dihydroxy(oxo)azanium;2-(3-methylsulfanylphenyl)guanidine?
The CAS number of Dihydroxy(oxo)azanium;2-(3-methylsulfanylphenyl)guanidine is 71198-44-2.
What is the molecular formula of Dihydroxy(oxo)azanium;2-(3-methylsulfanylphenyl)guanidine?
The molecular formula of Dihydroxy(oxo)azanium;2-(3-methylsulfanylphenyl)guanidine is C8H13N4O3S+.
What is the molecular weight of Dihydroxy(oxo)azanium;2-(3-methylsulfanylphenyl)guanidine?
The molecular weight of Dihydroxy(oxo)azanium;2-(3-methylsulfanylphenyl)guanidine is 245.07 g/mol.
Where can I buy Dihydroxy(oxo)azanium;2-(3-methylsulfanylphenyl)guanidine?
You can request a quote for Dihydroxy(oxo)azanium;2-(3-methylsulfanylphenyl)guanidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dihydroxy(oxo)azanium;2-(3-methylsulfanylphenyl)guanidine?
Yes, KEHONG BIO provides custom synthesis services for Dihydroxy(oxo)azanium;2-(3-methylsulfanylphenyl)guanidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.