S-(2-Fluoroethyl)isothiourea F-18
TL;DR: S-(2-Fluoroethyl)isothiourea F-18 (CAS 185247-75-0) is a chemical compound with molecular formula C3H7FN2S and molecular weight 121.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(18F)fluoroethyl carbamimidothioate
Also Known As: S-(2-Fluoroethyl)isothiourea F-18, S-(2-Fluoroethyl)isothiourea, F-18, 2-fluoranylethyl carbamimidothioate, 2-[2-(18F)Fluoroethyl]isothiourea, Carbamimidothioic acid, 2-(fluoro-18F)ethyl ester
| Molecular Formula | C3H7FN2S |
|---|---|
| Molecular Weight | 121.03 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 75.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 121.033936 |
| Heavy Atoms | 7 |
| Complexity | 66.0 |
Chemical Identifiers
| CAS Number | 185247-75-0 |
|---|---|
| SMILES | C(CSC(=N)N)[18F] |
| InChIKey | OOOBJDSBUDMEPW-NUTRPMROSA-N |
Product Overview
S-(2-Fluoroethyl)isothiourea F-18 (CAS 185247-75-0), with molecular formula C3H7FN2S and molecular weight 121.03 g/mol. IUPAC: 2-(18F)fluoroethyl carbamimidothioate.
Chemical Property Profile of S-(2-Fluoroethyl)isothiourea F-18
Property Insights of S-(2-Fluoroethyl)isothiourea F-18
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for S-(2-Fluoroethyl)isothiourea F-18. The TPSA of 75.2 Ų falls within the moderate polarity range, balancing permeability and solubility for S-(2-Fluoroethyl)isothiourea F-18. Following Lipinski's Rule of Five, S-(2-Fluoroethyl)isothiourea F-18 has 2 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 S-(2-Fluoroethyl)isothiourea F-18?
The CAS number of S-(2-Fluoroethyl)isothiourea F-18 is 185247-75-0.
What is the molecular formula of S-(2-Fluoroethyl)isothiourea F-18?
The molecular formula of S-(2-Fluoroethyl)isothiourea F-18 is C3H7FN2S.
What is the molecular weight of S-(2-Fluoroethyl)isothiourea F-18?
The molecular weight of S-(2-Fluoroethyl)isothiourea F-18 is 121.03 g/mol.
Where can I buy S-(2-Fluoroethyl)isothiourea F-18?
You can request a quote for S-(2-Fluoroethyl)isothiourea F-18 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for S-(2-Fluoroethyl)isothiourea F-18?
Yes, KEHONG BIO provides custom synthesis services for S-(2-Fluoroethyl)isothiourea F-18 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.