![1-[4-(3-fluoroanilino)-1-(2-furylmethyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]pyridinium chloride structure](/static/products/2812/281223-40-3.webp)
1-[4-(3-fluoroanilino)-1-(2-furylmethyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]pyridinium chloride
TL;DR: 1-[4-(3-fluoroanilino)-1-(2-furylmethyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]pyridinium chloride (CAS 281223-40-3) is a chemical compound with molecular formula C20H15ClFN3O3 and molecular weight 399.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3-fluoroanilino)-1-(furan-2-ylmethyl)-4-pyridin-1-ium-1-ylpyrrole-2,5-dione chloride
Also Known As: 1-[4-(3-fluoroanilino)-1-(2-furylmethyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]pyridinium chloride, 3-(3-fluoroanilino)-1-(furan-2-ylmethyl)-4-pyridin-1-ium-1-ylpyrrole-2,5-dione chloride, 3-(3-fluoroanilino)-1-(furan-2-ylmethyl)-4-pyridin-1-ium-1-ylpyrrole-2,5-dione;chloride, 3-[(3-fluorophenyl)amino]-1-(2-furylmethyl)-4-pyridin-1-yl-pyrrole-2,5-dione Chloride, 1-{4-[(3-fluorophenyl)amino]-1-(furan-2-ylmethyl)-2,5-dioxopyrrol-3-yl}-1$l^{5}-pyridin-1-ylium chloride
| Molecular Formula | C20H15ClFN3O3 |
|---|---|
| Molecular Weight | 399.08 g/mol |
| LogP | -0.4401 |
| Topological Polar Surface Area | 66.43 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 399.07858 |
| Heavy Atoms | 28 |
| Complexity | 1035.869 |
Chemical Identifiers
| CAS Number | 281223-40-3 |
|---|---|
| SMILES | C1=CC=[N+](C=C1)C2=C(C(=O)N(C2=O)CC3=CC=CO3)NC4=CC(=CC=C4)F.[Cl-] |
Product Overview
1-[4-(3-fluoroanilino)-1-(2-furylmethyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]pyridinium chloride (CAS 281223-40-3), with molecular formula C20H15ClFN3O3 and molecular weight 399.08 g/mol. IUPAC: 3-(3-fluoroanilino)-1-(furan-2-ylmethyl)-4-pyridin-1-ium-1-ylpyrrole-2,5-dione chloride.
Chemical Property Profile of 1-[4-(3-fluoroanilino)-1-(2-furylmethyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]pyridinium chloride
Property Insights of 1-[4-(3-fluoroanilino)-1-(2-furylmethyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]pyridinium chloride
The XLogP value of -0.4401 indicates that 1-[4-(3-fluoroanilino)-1-(2-furylmethyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]pyridinium chloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 66.43 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[4-(3-fluoroanilino)-1-(2-furylmethyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]pyridinium chloride. Following Lipinski's Rule of Five, 1-[4-(3-fluoroanilino)-1-(2-furylmethyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]pyridinium chloride has 1 hydrogen bond donor(s) and 4 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-[4-(3-fluoroanilino)-1-(2-furylmethyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]pyridinium chloride?
The CAS number of 1-[4-(3-fluoroanilino)-1-(2-furylmethyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]pyridinium chloride is 281223-40-3.
What is the molecular formula of 1-[4-(3-fluoroanilino)-1-(2-furylmethyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]pyridinium chloride?
The molecular formula of 1-[4-(3-fluoroanilino)-1-(2-furylmethyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]pyridinium chloride is C20H15ClFN3O3.
What is the molecular weight of 1-[4-(3-fluoroanilino)-1-(2-furylmethyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]pyridinium chloride?
The molecular weight of 1-[4-(3-fluoroanilino)-1-(2-furylmethyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]pyridinium chloride is 399.08 g/mol.
Where can I buy 1-[4-(3-fluoroanilino)-1-(2-furylmethyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]pyridinium chloride?
You can request a quote for 1-[4-(3-fluoroanilino)-1-(2-furylmethyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]pyridinium chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[4-(3-fluoroanilino)-1-(2-furylmethyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]pyridinium chloride?
Yes, KEHONG BIO provides custom synthesis services for 1-[4-(3-fluoroanilino)-1-(2-furylmethyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]pyridinium chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.