1-(3-Chloro-4-fluorophenyl)-3-[2-(4-fluorophenyl)ethyl]thiourea
TL;DR: 1-(3-Chloro-4-fluorophenyl)-3-[2-(4-fluorophenyl)ethyl]thiourea (CAS 708288-03-3) is a chemical compound with molecular formula C15H13ClF2N2S and molecular weight 326.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-chloro-4-fluorophenyl)-3-[2-(4-fluorophenyl)ethyl]thiourea
Also Known As: 1-(3-chloro-4-fluorophenyl)-3-[2-(4-fluorophenyl)ethyl]thiourea, N-(3-chloro-4-fluorophenyl)-N'-[2-(4-fluorophenyl)ethyl]thiourea, 1-(3-chloro-4-fluoro-phenyl)-3-[2-(4-fluorophenyl)ethyl]thiourea, 1-(3-chloranyl-4-fluoranyl-phenyl)-3-[2-(4-fluorophenyl)ethyl]thiourea, [(3-chloro-4-fluorophenyl)amino]{[2-(4-fluorophenyl)ethyl]amino}methane-1-thio ne
| Molecular Formula | C15H13ClF2N2S |
|---|---|
| Molecular Weight | 326.05 g/mol |
| LogP | 4.1473 |
| Topological Polar Surface Area | 24.06 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 326.0456 |
| Heavy Atoms | 21 |
| Complexity | 632.0708 |
Chemical Identifiers
| CAS Number | 708288-03-3 |
|---|---|
| SMILES | C1=CC(=CC=C1CCNC(=S)NC2=CC(=C(C=C2)F)Cl)F |
Product Overview
1-(3-Chloro-4-fluorophenyl)-3-[2-(4-fluorophenyl)ethyl]thiourea (CAS 708288-03-3), with molecular formula C15H13ClF2N2S and molecular weight 326.05 g/mol. IUPAC: 1-(3-chloro-4-fluorophenyl)-3-[2-(4-fluorophenyl)ethyl]thiourea.
Chemical Property Profile of 1-(3-Chloro-4-fluorophenyl)-3-[2-(4-fluorophenyl)ethyl]thiourea
Property Insights of 1-(3-Chloro-4-fluorophenyl)-3-[2-(4-fluorophenyl)ethyl]thiourea
The XLogP value of 4.1473 indicates that 1-(3-Chloro-4-fluorophenyl)-3-[2-(4-fluorophenyl)ethyl]thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.06 Ų, 1-(3-Chloro-4-fluorophenyl)-3-[2-(4-fluorophenyl)ethyl]thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3-Chloro-4-fluorophenyl)-3-[2-(4-fluorophenyl)ethyl]thiourea has 2 hydrogen bond donor(s) and 1 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 1-(3-Chloro-4-fluorophenyl)-3-[2-(4-fluorophenyl)ethyl]thiourea?
The CAS number of 1-(3-Chloro-4-fluorophenyl)-3-[2-(4-fluorophenyl)ethyl]thiourea is 708288-03-3.
What is the molecular formula of 1-(3-Chloro-4-fluorophenyl)-3-[2-(4-fluorophenyl)ethyl]thiourea?
The molecular formula of 1-(3-Chloro-4-fluorophenyl)-3-[2-(4-fluorophenyl)ethyl]thiourea is C15H13ClF2N2S.
What is the molecular weight of 1-(3-Chloro-4-fluorophenyl)-3-[2-(4-fluorophenyl)ethyl]thiourea?
The molecular weight of 1-(3-Chloro-4-fluorophenyl)-3-[2-(4-fluorophenyl)ethyl]thiourea is 326.05 g/mol.
Where can I buy 1-(3-Chloro-4-fluorophenyl)-3-[2-(4-fluorophenyl)ethyl]thiourea?
You can request a quote for 1-(3-Chloro-4-fluorophenyl)-3-[2-(4-fluorophenyl)ethyl]thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3-Chloro-4-fluorophenyl)-3-[2-(4-fluorophenyl)ethyl]thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-Chloro-4-fluorophenyl)-3-[2-(4-fluorophenyl)ethyl]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.