IFLab1_006381
TL;DR: IFLab1_006381 (CAS 618425-64-2) is a chemical compound with molecular formula C23H22ClNO5 and molecular weight 427.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4-chlorophenyl)-4-[hydroxy-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-1-(2-methoxyethyl)pyrrolidine-2,3-dione
Also Known As: IFLab1_006381, 5-(4-chlorophenyl)-3-hydroxy-1-(2-methoxyethyl)-4-(2-methyl-2,3-dihydro-1-benzofuran-5-carbonyl)-2,5-dihydro-1H-pyrrol-2-one, 5-(4-chlorophenyl)-4-[hydroxy-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-1-(2-methoxyethyl)pyrrolidine-2,3-dione
| Molecular Formula | C23H22ClNO5 |
|---|---|
| Molecular Weight | 427.12 g/mol |
| LogP | 3.7315 |
| Topological Polar Surface Area | 76.07 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 427.11865 |
| Heavy Atoms | 30 |
| Complexity | 1030.389 |
Chemical Identifiers
| CAS Number | 618425-64-2 |
|---|---|
| SMILES | CC1CC2=C(O1)C=CC(=C2)C(=C3C(N(C(=O)C3=O)CCOC)C4=CC=C(C=C4)Cl)O |
Product Overview
IFLab1_006381 (CAS 618425-64-2), with molecular formula C23H22ClNO5 and molecular weight 427.12 g/mol. IUPAC: 5-(4-chlorophenyl)-4-[hydroxy-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]-1-(2-methoxyethyl)pyrrolidine-2,3-dione.
Chemical Property Profile of IFLab1_006381
Property Insights of IFLab1_006381
The XLogP value of 3.7315 indicates that IFLab1_006381 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.07 Ų falls within the moderate polarity range, balancing permeability and solubility for IFLab1_006381. Following Lipinski's Rule of Five, IFLab1_006381 has 1 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 IFLab1_006381?
The CAS number of IFLab1_006381 is 618425-64-2.
What is the molecular formula of IFLab1_006381?
The molecular formula of IFLab1_006381 is C23H22ClNO5.
What is the molecular weight of IFLab1_006381?
The molecular weight of IFLab1_006381 is 427.12 g/mol.
Where can I buy IFLab1_006381?
You can request a quote for IFLab1_006381 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for IFLab1_006381?
Yes, KEHONG BIO provides custom synthesis services for IFLab1_006381 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.