A1953/0082085
TL;DR: A1953/0082085 (CAS 312512-46-2) is a chemical compound with molecular formula C26H23NO4 and molecular weight 413.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-4-[hydroxy(phenyl)methylidene]-5-(2-methoxyphenyl)-1-(2-phenylethyl)pyrrolidine-2,3-dione
Also Known As: A1953/0082085, 4-benzoyl-3-hydroxy-5-(2-methoxyphenyl)-1-phenethyl-1H-pyrrol-2(5H)-one, (4E)-4-[hydroxy(phenyl)methylidene]-5-(2-methoxyphenyl)-1-phenethylpyrrolidine-2,3-dione, 4-benzoyl-3-hydroxy-5-(2-methoxyphenyl)-1-(2-phenylethyl)-1,5-dihydro-2H-pyrrol-2-one, 3-hydroxy-5-(2-methoxyphenyl)-4-(phenylcarbonyl)-1-(2-phenylethyl)-1,5-dihydro-2H-pyrrol-2-one
| Molecular Formula | C26H23NO4 |
|---|---|
| Molecular Weight | 413.16 g/mol |
| LogP | 4.3596 |
| Topological Polar Surface Area | 66.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 413.16272 |
| Heavy Atoms | 31 |
| Complexity | 1122.4135 |
Chemical Identifiers
| CAS Number | 312512-46-2 |
|---|---|
| SMILES | COC1=CC=CC=C1C2/C(=C(/C3=CC=CC=C3)\O)/C(=O)C(=O)N2CCC4=CC=CC=C4 |
Product Overview
A1953/0082085 (CAS 312512-46-2), with molecular formula C26H23NO4 and molecular weight 413.16 g/mol. IUPAC: (4E)-4-[hydroxy(phenyl)methylidene]-5-(2-methoxyphenyl)-1-(2-phenylethyl)pyrrolidine-2,3-dione.
Chemical Property Profile of A1953/0082085
Property Insights of A1953/0082085
The XLogP value of 4.3596 indicates that A1953/0082085 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.84 Ų falls within the moderate polarity range, balancing permeability and solubility for A1953/0082085. Following Lipinski's Rule of Five, A1953/0082085 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 A1953/0082085?
The CAS number of A1953/0082085 is 312512-46-2.
What is the molecular formula of A1953/0082085?
The molecular formula of A1953/0082085 is C26H23NO4.
What is the molecular weight of A1953/0082085?
The molecular weight of A1953/0082085 is 413.16 g/mol.
Where can I buy A1953/0082085?
You can request a quote for A1953/0082085 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A1953/0082085?
Yes, KEHONG BIO provides custom synthesis services for A1953/0082085 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.