RefChem:529680
TL;DR: RefChem:529680 (CAS 618074-47-8) is a chemical compound with molecular formula C24H17Cl2FN2O4 and molecular weight 486.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-5-(3,4-dichlorophenyl)-4-[(3-fluoro-4-methoxyphenyl)-hydroxymethylidene]-1-(pyridin-4-ylmethyl)pyrrolidine-2,3-dione
Also Known As: 5-(3,4-Dichlorophenyl)-4-(3-fluoro-4-methoxybenzoyl)-3-hydroxy-1-(pyridin-4-ylmethyl)-1H-pyrrol-2(5H)-one, 5-(3,4-DICHLOROPHENYL)-4-(3-FLUORO-4-METHOXYBENZOYL)-3-HYDROXY-1-(4-PYRIDINYLMETHYL)-1,5-DIHYDRO-2H-PYRROL-2-ONE, 645-573-3, RefChem:529680
| Molecular Formula | C24H17Cl2FN2O4 |
|---|---|
| Molecular Weight | 486.05 g/mol |
| LogP | 5.158 |
| Topological Polar Surface Area | 79.73 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 486.05493 |
| Heavy Atoms | 33 |
| Complexity | 1280.7108 |
Chemical Identifiers
| CAS Number | 618074-47-8 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)/C(=C\2/C(N(C(=O)C2=O)CC3=CC=NC=C3)C4=CC(=C(C=C4)Cl)Cl)/O)F |
Product Overview
RefChem:529680 (CAS 618074-47-8), with molecular formula C24H17Cl2FN2O4 and molecular weight 486.05 g/mol. IUPAC: (4E)-5-(3,4-dichlorophenyl)-4-[(3-fluoro-4-methoxyphenyl)-hydroxymethylidene]-1-(pyridin-4-ylmethyl)pyrrolidine-2,3-dione.
Chemical Property Profile of RefChem:529680
Property Insights of RefChem:529680
The XLogP value of 5.158 indicates that RefChem:529680 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.73 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:529680. Following Lipinski's Rule of Five, RefChem:529680 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:529680?
The CAS number of RefChem:529680 is 618074-47-8.
What is the molecular formula of RefChem:529680?
The molecular formula of RefChem:529680 is C24H17Cl2FN2O4.
What is the molecular weight of RefChem:529680?
The molecular weight of RefChem:529680 is 486.05 g/mol.
Where can I buy RefChem:529680?
You can request a quote for RefChem:529680 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:529680?
Yes, KEHONG BIO provides custom synthesis services for RefChem:529680 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.