3-{[4-Chloro-1-(4-fluorophenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]amino}-N-(4-iodophenyl)benzamide
TL;DR: 3-{[4-Chloro-1-(4-fluorophenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]amino}-N-(4-iodophenyl)benzamide (CAS 6905-32-4) is a chemical compound with molecular formula C23H14ClFIN3O3 and molecular weight 560.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[4-chloro-1-(4-fluorophenyl)-2,5-dioxopyrrol-3-yl]amino]-N-(4-iodophenyl)benzamide
Also Known As: 3-{[4-Chloro-1-(4-fluorophenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]amino}-N-(4-iodophenyl)benzamide, 3-[[4-chloro-1-(4-fluorophenyl)-2,5-dioxo-pyrrol-3-yl]amino]-N-(4-iodophenyl)benzamide, 3-[[4-chloro-1-(4-fluorophenyl)-2,5-dioxopyrrol-3-yl]amino]-N-(4-iodophenyl)benzamide
| Molecular Formula | C23H14ClFIN3O3 |
|---|---|
| Molecular Weight | 560.98 g/mol |
| LogP | 5.1183 |
| Topological Polar Surface Area | 78.51 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 560.9752 |
| Heavy Atoms | 32 |
| Complexity | 1260.238 |
Chemical Identifiers
| CAS Number | 6905-32-4 |
|---|---|
| SMILES | C1=CC(=CC(=C1)NC2=C(C(=O)N(C2=O)C3=CC=C(C=C3)F)Cl)C(=O)NC4=CC=C(C=C4)I |
Product Overview
3-{[4-Chloro-1-(4-fluorophenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]amino}-N-(4-iodophenyl)benzamide (CAS 6905-32-4), with molecular formula C23H14ClFIN3O3 and molecular weight 560.98 g/mol. IUPAC: 3-[[4-chloro-1-(4-fluorophenyl)-2,5-dioxopyrrol-3-yl]amino]-N-(4-iodophenyl)benzamide.
Chemical Property Profile of 3-{[4-Chloro-1-(4-fluorophenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]amino}-N-(4-iodophenyl)benzamide
Property Insights of 3-{[4-Chloro-1-(4-fluorophenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]amino}-N-(4-iodophenyl)benzamide
The XLogP value of 5.1183 indicates that 3-{[4-Chloro-1-(4-fluorophenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]amino}-N-(4-iodophenyl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.51 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-{[4-Chloro-1-(4-fluorophenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]amino}-N-(4-iodophenyl)benzamide. Following Lipinski's Rule of Five, 3-{[4-Chloro-1-(4-fluorophenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]amino}-N-(4-iodophenyl)benzamide has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-{[4-Chloro-1-(4-fluorophenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]amino}-N-(4-iodophenyl)benzamide?
The CAS number of 3-{[4-Chloro-1-(4-fluorophenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]amino}-N-(4-iodophenyl)benzamide is 6905-32-4.
What is the molecular formula of 3-{[4-Chloro-1-(4-fluorophenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]amino}-N-(4-iodophenyl)benzamide?
The molecular formula of 3-{[4-Chloro-1-(4-fluorophenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]amino}-N-(4-iodophenyl)benzamide is C23H14ClFIN3O3.
What is the molecular weight of 3-{[4-Chloro-1-(4-fluorophenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]amino}-N-(4-iodophenyl)benzamide?
The molecular weight of 3-{[4-Chloro-1-(4-fluorophenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]amino}-N-(4-iodophenyl)benzamide is 560.98 g/mol.
Where can I buy 3-{[4-Chloro-1-(4-fluorophenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]amino}-N-(4-iodophenyl)benzamide?
You can request a quote for 3-{[4-Chloro-1-(4-fluorophenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]amino}-N-(4-iodophenyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-{[4-Chloro-1-(4-fluorophenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]amino}-N-(4-iodophenyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 3-{[4-Chloro-1-(4-fluorophenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]amino}-N-(4-iodophenyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.