![3-(4-Fluorophenyl)-N-{[3-(hydroxymethyl)phenyl]carbamothioyl}prop-2-enamide structure](/static/products/6978/6978-70-7.webp)
3-(4-Fluorophenyl)-N-{[3-(hydroxymethyl)phenyl]carbamothioyl}prop-2-enamide
TL;DR: 3-(4-Fluorophenyl)-N-{[3-(hydroxymethyl)phenyl]carbamothioyl}prop-2-enamide (CAS 6978-70-7) is a chemical compound with molecular formula C17H15FN2O2S and molecular weight 330.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-fluorophenyl)-N-[[3-(hydroxymethyl)phenyl]carbamothioyl]prop-2-enamide
Also Known As: 3-(4-Fluorophenyl)-N-{[3-(hydroxymethyl)phenyl]carbamothioyl}prop-2-enamide, 3-(4-fluorophenyl)-N-[[3-(hydroxymethyl)phenyl]carbamothioyl]prop-2-enamide, 3-(4-fluorophenyl)-N-[[3-(hydroxymethyl)phenyl]thiocarbamoyl]prop-2-enamide
| Molecular Formula | C17H15FN2O2S |
|---|---|
| Molecular Weight | 330.08 g/mol |
| LogP | 2.8444 |
| Topological Polar Surface Area | 61.36 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 330.08383 |
| Heavy Atoms | 23 |
| Complexity | 729.6282 |
Chemical Identifiers
| CAS Number | 6978-70-7 |
|---|---|
| SMILES | C1=CC(=CC(=C1)NC(=S)NC(=O)C=CC2=CC=C(C=C2)F)CO |
Product Overview
3-(4-Fluorophenyl)-N-{[3-(hydroxymethyl)phenyl]carbamothioyl}prop-2-enamide (CAS 6978-70-7), with molecular formula C17H15FN2O2S and molecular weight 330.08 g/mol. IUPAC: 3-(4-fluorophenyl)-N-[[3-(hydroxymethyl)phenyl]carbamothioyl]prop-2-enamide.
Chemical Property Profile of 3-(4-Fluorophenyl)-N-{[3-(hydroxymethyl)phenyl]carbamothioyl}prop-2-enamide
Property Insights of 3-(4-Fluorophenyl)-N-{[3-(hydroxymethyl)phenyl]carbamothioyl}prop-2-enamide
The XLogP value of 2.8444 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(4-Fluorophenyl)-N-{[3-(hydroxymethyl)phenyl]carbamothioyl}prop-2-enamide. The TPSA of 61.36 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(4-Fluorophenyl)-N-{[3-(hydroxymethyl)phenyl]carbamothioyl}prop-2-enamide. Following Lipinski's Rule of Five, 3-(4-Fluorophenyl)-N-{[3-(hydroxymethyl)phenyl]carbamothioyl}prop-2-enamide has 3 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 3-(4-Fluorophenyl)-N-{[3-(hydroxymethyl)phenyl]carbamothioyl}prop-2-enamide?
The CAS number of 3-(4-Fluorophenyl)-N-{[3-(hydroxymethyl)phenyl]carbamothioyl}prop-2-enamide is 6978-70-7.
What is the molecular formula of 3-(4-Fluorophenyl)-N-{[3-(hydroxymethyl)phenyl]carbamothioyl}prop-2-enamide?
The molecular formula of 3-(4-Fluorophenyl)-N-{[3-(hydroxymethyl)phenyl]carbamothioyl}prop-2-enamide is C17H15FN2O2S.
What is the molecular weight of 3-(4-Fluorophenyl)-N-{[3-(hydroxymethyl)phenyl]carbamothioyl}prop-2-enamide?
The molecular weight of 3-(4-Fluorophenyl)-N-{[3-(hydroxymethyl)phenyl]carbamothioyl}prop-2-enamide is 330.08 g/mol.
Where can I buy 3-(4-Fluorophenyl)-N-{[3-(hydroxymethyl)phenyl]carbamothioyl}prop-2-enamide?
You can request a quote for 3-(4-Fluorophenyl)-N-{[3-(hydroxymethyl)phenyl]carbamothioyl}prop-2-enamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-Fluorophenyl)-N-{[3-(hydroxymethyl)phenyl]carbamothioyl}prop-2-enamide?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Fluorophenyl)-N-{[3-(hydroxymethyl)phenyl]carbamothioyl}prop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.