4-Amino-2-(2-fluoroanilino)-5-(4-fluorobenzoyl)thiophene-3-carbonitrile
TL;DR: 4-Amino-2-(2-fluoroanilino)-5-(4-fluorobenzoyl)thiophene-3-carbonitrile (CAS 674806-84-9) is a chemical compound with molecular formula C18H11F2N3OS and molecular weight 355.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-amino-2-(2-fluoroanilino)-5-(4-fluorobenzoyl)thiophene-3-carbonitrile
Also Known As: AM-807/12739049, 4-amino-2-(2-fluoroanilino)-5-(4-fluorobenzoyl)thiophene-3-carbonitrile, A3460/0146826, 4-amino-2-(2-fluoroanilino)-5-(4-fluorobenzoyl)-3-thiophenecarbonitrile, 4-amino-2-[(2-fluorophenyl)amino]-5-[(4-fluorophenyl)carbonyl]thiophene-3-carbonitrile
| Molecular Formula | C18H11F2N3OS |
|---|---|
| Molecular Weight | 355.06 g/mol |
| LogP | 4.45478 |
| Topological Polar Surface Area | 78.91 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 355.05908 |
| Heavy Atoms | 25 |
| Complexity | 990.546 |
Chemical Identifiers
| CAS Number | 674806-84-9 |
|---|---|
| SMILES | C1=CC=C(C(=C1)NC2=C(C(=C(S2)C(=O)C3=CC=C(C=C3)F)N)C#N)F |
Product Overview
4-Amino-2-(2-fluoroanilino)-5-(4-fluorobenzoyl)thiophene-3-carbonitrile (CAS 674806-84-9), with molecular formula C18H11F2N3OS and molecular weight 355.06 g/mol. IUPAC: 4-amino-2-(2-fluoroanilino)-5-(4-fluorobenzoyl)thiophene-3-carbonitrile.
Chemical Property Profile of 4-Amino-2-(2-fluoroanilino)-5-(4-fluorobenzoyl)thiophene-3-carbonitrile
Property Insights of 4-Amino-2-(2-fluoroanilino)-5-(4-fluorobenzoyl)thiophene-3-carbonitrile
The XLogP value of 4.45478 indicates that 4-Amino-2-(2-fluoroanilino)-5-(4-fluorobenzoyl)thiophene-3-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.91 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Amino-2-(2-fluoroanilino)-5-(4-fluorobenzoyl)thiophene-3-carbonitrile. Following Lipinski's Rule of Five, 4-Amino-2-(2-fluoroanilino)-5-(4-fluorobenzoyl)thiophene-3-carbonitrile has 2 hydrogen bond donor(s) and 5 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 4-Amino-2-(2-fluoroanilino)-5-(4-fluorobenzoyl)thiophene-3-carbonitrile?
The CAS number of 4-Amino-2-(2-fluoroanilino)-5-(4-fluorobenzoyl)thiophene-3-carbonitrile is 674806-84-9.
What is the molecular formula of 4-Amino-2-(2-fluoroanilino)-5-(4-fluorobenzoyl)thiophene-3-carbonitrile?
The molecular formula of 4-Amino-2-(2-fluoroanilino)-5-(4-fluorobenzoyl)thiophene-3-carbonitrile is C18H11F2N3OS.
What is the molecular weight of 4-Amino-2-(2-fluoroanilino)-5-(4-fluorobenzoyl)thiophene-3-carbonitrile?
The molecular weight of 4-Amino-2-(2-fluoroanilino)-5-(4-fluorobenzoyl)thiophene-3-carbonitrile is 355.06 g/mol.
Where can I buy 4-Amino-2-(2-fluoroanilino)-5-(4-fluorobenzoyl)thiophene-3-carbonitrile?
You can request a quote for 4-Amino-2-(2-fluoroanilino)-5-(4-fluorobenzoyl)thiophene-3-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Amino-2-(2-fluoroanilino)-5-(4-fluorobenzoyl)thiophene-3-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 4-Amino-2-(2-fluoroanilino)-5-(4-fluorobenzoyl)thiophene-3-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.