A2233/0093954
TL;DR: A2233/0093954 (CAS 309727-65-9) is a chemical compound with molecular formula C22H21ClN2O5 and molecular weight 428.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-[(3E)-3-[(4-chlorophenyl)-hydroxymethylidene]-2-(4-methoxyphenyl)-4,5-dioxopyrrolidin-1-yl]ethyl]acetamide
Also Known As: A2233/0093954, N-(2-(3-(4-chlorobenzoyl)-4-hydroxy-2-(4-methoxyphenyl)-5-oxo-2,5-dihydro-1H-pyrrol-1-yl)ethyl)acetamide, N-[2-[(3E)-3-[(4-chlorophenyl)-hydroxymethylidene]-2-(4-methoxyphenyl)-4,5-dioxopyrrolidin-1-yl]ethyl]acetamide, N-{2-[(3E)-3-[(4-chlorophenyl)(hydroxy)methylidene]-2-(4-methoxyphenyl)-4,5-dioxopyrrolidin-1-yl]ethyl}acetamide
| Molecular Formula | C22H21ClN2O5 |
|---|---|
| Molecular Weight | 428.11 g/mol |
| LogP | 2.9064 |
| Topological Polar Surface Area | 95.94 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 428.1139 |
| Heavy Atoms | 30 |
| Complexity | 999.1929 |
Chemical Identifiers
| CAS Number | 309727-65-9 |
|---|---|
| SMILES | CC(=O)NCCN1C(/C(=C(/C2=CC=C(C=C2)Cl)\O)/C(=O)C1=O)C3=CC=C(C=C3)OC |
Product Overview
A2233/0093954 (CAS 309727-65-9), with molecular formula C22H21ClN2O5 and molecular weight 428.11 g/mol. IUPAC: N-[2-[(3E)-3-[(4-chlorophenyl)-hydroxymethylidene]-2-(4-methoxyphenyl)-4,5-dioxopyrrolidin-1-yl]ethyl]acetamide.
Chemical Property Profile of A2233/0093954
Property Insights of A2233/0093954
The XLogP value of 2.9064 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A2233/0093954. The TPSA of 95.94 Ų falls within the moderate polarity range, balancing permeability and solubility for A2233/0093954. Following Lipinski's Rule of Five, A2233/0093954 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 A2233/0093954?
The CAS number of A2233/0093954 is 309727-65-9.
What is the molecular formula of A2233/0093954?
The molecular formula of A2233/0093954 is C22H21ClN2O5.
What is the molecular weight of A2233/0093954?
The molecular weight of A2233/0093954 is 428.11 g/mol.
Where can I buy A2233/0093954?
You can request a quote for A2233/0093954 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2233/0093954?
Yes, KEHONG BIO provides custom synthesis services for A2233/0093954 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.