![3-[(3-Fluorophenyl)amino]-1-(2-thienyl)-1-propanone structure](/static/products/7257/725702-36-3.webp)
3-[(3-Fluorophenyl)amino]-1-(2-thienyl)-1-propanone
TL;DR: 3-[(3-Fluorophenyl)amino]-1-(2-thienyl)-1-propanone (CAS 725702-36-3) is a chemical compound with molecular formula C13H12FNOS and molecular weight 249.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3-fluoroanilino)-1-thiophen-2-ylpropan-1-one
Also Known As: 3-[(3-Fluorophenyl)amino]-1-(2-thienyl)-1-propanone, 3-(3-fluoroanilino)-1-thiophen-2-ylpropan-1-one, 3-(3-Fluoroanilino)-1-(thiophen-2-yl)propan-1-one, 3-[(3-fluorophenyl)amino]-1-(2-thienyl)propan-1-one
| Molecular Formula | C13H12FNOS |
|---|---|
| Molecular Weight | 249.06 g/mol |
| LogP | 3.5721 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 249.06236 |
| Heavy Atoms | 17 |
| Complexity | 495.8804 |
Chemical Identifiers
| CAS Number | 725702-36-3 |
|---|---|
| SMILES | C1=CC(=CC(=C1)F)NCCC(=O)C2=CC=CS2 |
Product Overview
3-[(3-Fluorophenyl)amino]-1-(2-thienyl)-1-propanone (CAS 725702-36-3), with molecular formula C13H12FNOS and molecular weight 249.06 g/mol. IUPAC: 3-(3-fluoroanilino)-1-thiophen-2-ylpropan-1-one.
Chemical Property Profile of 3-[(3-Fluorophenyl)amino]-1-(2-thienyl)-1-propanone
Property Insights of 3-[(3-Fluorophenyl)amino]-1-(2-thienyl)-1-propanone
The XLogP value of 3.5721 indicates that 3-[(3-Fluorophenyl)amino]-1-(2-thienyl)-1-propanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, 3-[(3-Fluorophenyl)amino]-1-(2-thienyl)-1-propanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[(3-Fluorophenyl)amino]-1-(2-thienyl)-1-propanone has 1 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-[(3-Fluorophenyl)amino]-1-(2-thienyl)-1-propanone?
The CAS number of 3-[(3-Fluorophenyl)amino]-1-(2-thienyl)-1-propanone is 725702-36-3.
What is the molecular formula of 3-[(3-Fluorophenyl)amino]-1-(2-thienyl)-1-propanone?
The molecular formula of 3-[(3-Fluorophenyl)amino]-1-(2-thienyl)-1-propanone is C13H12FNOS.
What is the molecular weight of 3-[(3-Fluorophenyl)amino]-1-(2-thienyl)-1-propanone?
The molecular weight of 3-[(3-Fluorophenyl)amino]-1-(2-thienyl)-1-propanone is 249.06 g/mol.
Where can I buy 3-[(3-Fluorophenyl)amino]-1-(2-thienyl)-1-propanone?
You can request a quote for 3-[(3-Fluorophenyl)amino]-1-(2-thienyl)-1-propanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(3-Fluorophenyl)amino]-1-(2-thienyl)-1-propanone?
Yes, KEHONG BIO provides custom synthesis services for 3-[(3-Fluorophenyl)amino]-1-(2-thienyl)-1-propanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.