(3-Chloro-4-fluorophenyl)thiourea
TL;DR: (3-Chloro-4-fluorophenyl)thiourea (CAS 154371-25-2) is a chemical compound with molecular formula C7H6ClFN2S and molecular weight 203.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-chloro-4-fluorophenyl)thiourea
Also Known As: (3-chloro-4-fluorophenyl)thiourea, 3-chloro-4-fluorophenylthiourea, 1-(3-Chloro-4-fluorophenyl)-2-thiourea, (3-Chloro-4-fluoro-phenyl)-thiourea, N-(3-chloro-4-fluorophenyl)thiourea
| Molecular Formula | C7H6ClFN2S |
|---|---|
| Molecular Weight | 203.99 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 70.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 203.99243 |
| Heavy Atoms | 12 |
| Complexity | 179.0 |
Chemical Identifiers
| CAS Number | 154371-25-2 |
|---|---|
| SMILES | C1=CC(=C(C=C1NC(=S)N)Cl)F |
| InChIKey | OVJVZVPEMXLKOE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(3-Chloro-4-fluorophenyl)thiourea (CAS 154371-25-2), with molecular formula C7H6ClFN2S and molecular weight 203.99 g/mol. IUPAC: (3-chloro-4-fluorophenyl)thiourea.
Chemical Property Profile of (3-Chloro-4-fluorophenyl)thiourea
Property Insights of (3-Chloro-4-fluorophenyl)thiourea
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3-Chloro-4-fluorophenyl)thiourea. The TPSA of 70.1 Ų falls within the moderate polarity range, balancing permeability and solubility for (3-Chloro-4-fluorophenyl)thiourea. Following Lipinski's Rule of Five, (3-Chloro-4-fluorophenyl)thiourea 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 (3-Chloro-4-fluorophenyl)thiourea?
The CAS number of (3-Chloro-4-fluorophenyl)thiourea is 154371-25-2.
What is the molecular formula of (3-Chloro-4-fluorophenyl)thiourea?
The molecular formula of (3-Chloro-4-fluorophenyl)thiourea is C7H6ClFN2S.
What is the molecular weight of (3-Chloro-4-fluorophenyl)thiourea?
The molecular weight of (3-Chloro-4-fluorophenyl)thiourea is 203.99 g/mol.
Where can I buy (3-Chloro-4-fluorophenyl)thiourea?
You can request a quote for (3-Chloro-4-fluorophenyl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3-Chloro-4-fluorophenyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for (3-Chloro-4-fluorophenyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.