1-(3-Acetylphenyl)-3-(4-fluorophenyl)thiourea
TL;DR: 1-(3-Acetylphenyl)-3-(4-fluorophenyl)thiourea (CAS 314766-45-5) is a chemical compound with molecular formula C15H13FN2OS and molecular weight 288.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-acetylphenyl)-3-(4-fluorophenyl)thiourea
Also Known As: 1-(3-acetylphenyl)-3-(4-fluorophenyl)thiourea, N-(3-acetylphenyl)-N'-(4-fluorophenyl)thiourea, BAS 01175910, 1-(3-Acetyl-phenyl)-3-(4-fluoro-phenyl)-thiourea, AN-329/40396836
| Molecular Formula | C15H13FN2OS |
|---|---|
| Molecular Weight | 288.07 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 73.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 288.07327 |
| Heavy Atoms | 20 |
| Complexity | 356.0 |
Chemical Identifiers
| CAS Number | 314766-45-5 |
|---|---|
| SMILES | CC(=O)C1=CC(=CC=C1)NC(=S)NC2=CC=C(C=C2)F |
| InChIKey | DSCVSUMCXVBBHV-UHFFFAOYSA-N |
Product Overview
1-(3-Acetylphenyl)-3-(4-fluorophenyl)thiourea (CAS 314766-45-5), with molecular formula C15H13FN2OS and molecular weight 288.07 g/mol. IUPAC: 1-(3-acetylphenyl)-3-(4-fluorophenyl)thiourea.
Chemical Property Profile of 1-(3-Acetylphenyl)-3-(4-fluorophenyl)thiourea
Property Insights of 1-(3-Acetylphenyl)-3-(4-fluorophenyl)thiourea
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3-Acetylphenyl)-3-(4-fluorophenyl)thiourea. The TPSA of 73.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(3-Acetylphenyl)-3-(4-fluorophenyl)thiourea. Following Lipinski's Rule of Five, 1-(3-Acetylphenyl)-3-(4-fluorophenyl)thiourea 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 1-(3-Acetylphenyl)-3-(4-fluorophenyl)thiourea?
The CAS number of 1-(3-Acetylphenyl)-3-(4-fluorophenyl)thiourea is 314766-45-5.
What is the molecular formula of 1-(3-Acetylphenyl)-3-(4-fluorophenyl)thiourea?
The molecular formula of 1-(3-Acetylphenyl)-3-(4-fluorophenyl)thiourea is C15H13FN2OS.
What is the molecular weight of 1-(3-Acetylphenyl)-3-(4-fluorophenyl)thiourea?
The molecular weight of 1-(3-Acetylphenyl)-3-(4-fluorophenyl)thiourea is 288.07 g/mol.
Where can I buy 1-(3-Acetylphenyl)-3-(4-fluorophenyl)thiourea?
You can request a quote for 1-(3-Acetylphenyl)-3-(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 1-(3-Acetylphenyl)-3-(4-fluorophenyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-Acetylphenyl)-3-(4-fluorophenyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.