Guanidine, (2-(phenylthio)ethyl)-
TL;DR: Guanidine, (2-(phenylthio)ethyl)- (CAS 46231-44-1) is a chemical compound with molecular formula C9H13N3S and molecular weight 195.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-phenylsulfanylethyl)guanidine
Also Known As: (2-(Phenylthio)ethyl)guanidine, 2-(Phenylmercapto)ethylguanidine, furfuryl-pyridin-2-yl-amine, 2-(2-phenylsulfanylethyl)guanidine, GUANIDINE, (2-(PHENYLTHIO)ETHYL)-
| Molecular Formula | C9H13N3S |
|---|---|
| Molecular Weight | 195.08 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 89.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 195.08302 |
| Heavy Atoms | 13 |
| Complexity | 160.0 |
Chemical Identifiers
| CAS Number | 46231-44-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)SCCN=C(N)N |
| InChIKey | ISXGRENLXFCZDO-UHFFFAOYSA-N |
Product Overview
Guanidine, (2-(phenylthio)ethyl)- (CAS 46231-44-1), with molecular formula C9H13N3S and molecular weight 195.08 g/mol. IUPAC: 2-(2-phenylsulfanylethyl)guanidine.
Chemical Property Profile of Guanidine, (2-(phenylthio)ethyl)-
Property Insights of Guanidine, (2-(phenylthio)ethyl)-
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Guanidine, (2-(phenylthio)ethyl)-. The TPSA of 89.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Guanidine, (2-(phenylthio)ethyl)-. Following Lipinski's Rule of Five, Guanidine, (2-(phenylthio)ethyl)- has 2 hydrogen bond donor(s) and 2 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 Guanidine, (2-(phenylthio)ethyl)-?
The CAS number of Guanidine, (2-(phenylthio)ethyl)- is 46231-44-1.
What is the molecular formula of Guanidine, (2-(phenylthio)ethyl)-?
The molecular formula of Guanidine, (2-(phenylthio)ethyl)- is C9H13N3S.
What is the molecular weight of Guanidine, (2-(phenylthio)ethyl)-?
The molecular weight of Guanidine, (2-(phenylthio)ethyl)- is 195.08 g/mol.
Where can I buy Guanidine, (2-(phenylthio)ethyl)-?
You can request a quote for Guanidine, (2-(phenylthio)ethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Guanidine, (2-(phenylthio)ethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Guanidine, (2-(phenylthio)ethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.