ChemDiv1_027733
TL;DR: ChemDiv1_027733 (CAS 312280-98-1) is a chemical compound with molecular formula C23H17FN2O5S and molecular weight 452.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(3E)-2-(2-fluorophenyl)-3-[hydroxy(phenyl)methylidene]-4,5-dioxopyrrolidin-1-yl]benzenesulfonamide
Also Known As: ChemDiv1_027733, A1765/0074845, 4-[(3E)-2-(2-fluorophenyl)-3-[hydroxy(phenyl)methylidene]-4,5-dioxopyrrolidin-1-yl]benzenesulfonamide, 4-[3-BENZOYL-2-(2-FLUOROPHENYL)-4-HYDROXY-5-OXO-2,5-DIHYDRO-1H-PYRROL-1-YL]-1-BENZENESULFONAMIDE, 4-[3-benzoyl-2-(2-fluorophenyl)-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]benzenesulfonamide
| Molecular Formula | C23H17FN2O5S |
|---|---|
| Molecular Weight | 452.08 g/mol |
| LogP | 3.0994 |
| Topological Polar Surface Area | 117.77 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 452.08423 |
| Heavy Atoms | 32 |
| Complexity | 1352.6488 |
Chemical Identifiers
| CAS Number | 312280-98-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)/C(=C\2/C(N(C(=O)C2=O)C3=CC=C(C=C3)S(=O)(=O)N)C4=CC=CC=C4F)/O |
Product Overview
ChemDiv1_027733 (CAS 312280-98-1), with molecular formula C23H17FN2O5S and molecular weight 452.08 g/mol. IUPAC: 4-[(3E)-2-(2-fluorophenyl)-3-[hydroxy(phenyl)methylidene]-4,5-dioxopyrrolidin-1-yl]benzenesulfonamide.
Chemical Property Profile of ChemDiv1_027733
Property Insights of ChemDiv1_027733
The XLogP value of 3.0994 indicates that ChemDiv1_027733 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 117.77 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_027733. Following Lipinski's Rule of Five, ChemDiv1_027733 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 ChemDiv1_027733?
The CAS number of ChemDiv1_027733 is 312280-98-1.
What is the molecular formula of ChemDiv1_027733?
The molecular formula of ChemDiv1_027733 is C23H17FN2O5S.
What is the molecular weight of ChemDiv1_027733?
The molecular weight of ChemDiv1_027733 is 452.08 g/mol.
Where can I buy ChemDiv1_027733?
You can request a quote for ChemDiv1_027733 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_027733?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_027733 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.