AB00802522-01
TL;DR: AB00802522-01 (CAS 609316-68-9) is a chemical compound with molecular formula C26H25N3O6 and molecular weight 475.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[(3E)-3-[hydroxy-(3-methoxyphenyl)methylidene]-1-(3-imidazol-1-ylpropyl)-4,5-dioxopyrrolidin-2-yl]benzoate
Also Known As: AB00802522-01, AB00802522-02, methyl 4-(1-(3-(1H-imidazol-1-yl)propyl)-4-hydroxy-3-(3-methoxybenzoyl)-5-oxo-2,5-dihydro-1H-pyrrol-2-yl)benzoate, methyl 4-[(3E)-3-[hydroxy-(3-methoxyphenyl)methylidene]-1-(3-imidazol-1-ylpropyl)-4,5-dioxopyrrolidin-2-yl]benzoate, methyl 4-{4-hydroxy-1-(3-imidazolylpropyl)-3-[(3-methoxyphenyl)carbonyl]-5-oxo -3-pyrrolin-2-yl}benzoate
| Molecular Formula | C26H25N3O6 |
|---|---|
| Molecular Weight | 475.17 g/mol |
| LogP | 3.1903 |
| Topological Polar Surface Area | 110.96 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 475.17435 |
| Heavy Atoms | 35 |
| Complexity | 1264.5039 |
Chemical Identifiers
| CAS Number | 609316-68-9 |
|---|---|
| SMILES | COC1=CC=CC(=C1)/C(=C\2/C(N(C(=O)C2=O)CCCN3C=CN=C3)C4=CC=C(C=C4)C(=O)OC)/O |
Product Overview
AB00802522-01 (CAS 609316-68-9), with molecular formula C26H25N3O6 and molecular weight 475.17 g/mol. IUPAC: methyl 4-[(3E)-3-[hydroxy-(3-methoxyphenyl)methylidene]-1-(3-imidazol-1-ylpropyl)-4,5-dioxopyrrolidin-2-yl]benzoate.
Chemical Property Profile of AB00802522-01
Property Insights of AB00802522-01
The XLogP value of 3.1903 indicates that AB00802522-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 110.96 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00802522-01. Following Lipinski's Rule of Five, AB00802522-01 has 1 hydrogen bond donor(s) and 7 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 AB00802522-01?
The CAS number of AB00802522-01 is 609316-68-9.
What is the molecular formula of AB00802522-01?
The molecular formula of AB00802522-01 is C26H25N3O6.
What is the molecular weight of AB00802522-01?
The molecular weight of AB00802522-01 is 475.17 g/mol.
Where can I buy AB00802522-01?
You can request a quote for AB00802522-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00802522-01?
Yes, KEHONG BIO provides custom synthesis services for AB00802522-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.