AH-487/13097009
TL;DR: AH-487/13097009 (CAS 352558-45-3) is a chemical compound with molecular formula C22H21NO4 and molecular weight 363.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (5E)-1-(3,5-dimethylphenyl)-5-[(4-hydroxyphenyl)methylidene]-2-methyl-4-oxopyrrole-3-carboxylate
Also Known As: AH-487/13097009, methyl (5E)-1-(3,5-dimethylphenyl)-5-[(4-hydroxyphenyl)methylidene]-2-methyl-4-oxopyrrole-3-carboxylate, methyl (5E)-1-(3,5-dimethylphenyl)-5-(4-hydroxybenzylidene)-2-methyl-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate, methyl 1-(3,5-dimethylphenyl)-5-(4-hydroxybenzylidene)-2-methyl-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate, (E)-methyl 1-(3,5-dimethylphenyl)-5-(4-hydroxybenzylidene)-2-methyl-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
| Molecular Formula | C22H21NO4 |
|---|---|
| Molecular Weight | 363.15 g/mol |
| LogP | 3.88624 |
| Topological Polar Surface Area | 66.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 363.14706 |
| Heavy Atoms | 27 |
| Complexity | 963.62244 |
Chemical Identifiers
| CAS Number | 352558-45-3 |
|---|---|
| SMILES | CC1=CC(=CC(=C1)N\2C(=C(C(=O)/C2=C\C3=CC=C(C=C3)O)C(=O)OC)C)C |
Product Overview
AH-487/13097009 (CAS 352558-45-3), with molecular formula C22H21NO4 and molecular weight 363.15 g/mol. IUPAC: methyl (5E)-1-(3,5-dimethylphenyl)-5-[(4-hydroxyphenyl)methylidene]-2-methyl-4-oxopyrrole-3-carboxylate.
Chemical Property Profile of AH-487/13097009
Property Insights of AH-487/13097009
The XLogP value of 3.88624 indicates that AH-487/13097009 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 AH-487/13097009. Following Lipinski's Rule of Five, AH-487/13097009 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 AH-487/13097009?
The CAS number of AH-487/13097009 is 352558-45-3.
What is the molecular formula of AH-487/13097009?
The molecular formula of AH-487/13097009 is C22H21NO4.
What is the molecular weight of AH-487/13097009?
The molecular weight of AH-487/13097009 is 363.15 g/mol.
Where can I buy AH-487/13097009?
You can request a quote for AH-487/13097009 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AH-487/13097009?
Yes, KEHONG BIO provides custom synthesis services for AH-487/13097009 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.