AB00802749-01
TL;DR: AB00802749-01 (CAS 609312-89-2) is a chemical compound with molecular formula C25H22N2O5 and molecular weight 430.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-4-[hydroxy-(3-methoxyphenyl)methylidene]-5-(4-methoxyphenyl)-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione
Also Known As: AB00802749-01, 3-hydroxy-4-(3-methoxybenzoyl)-5-(4-methoxyphenyl)-1-(pyridin-3-ylmethyl)-1H-pyrrol-2(5H)-one, (4E)-4-[hydroxy-(3-methoxyphenyl)methylidene]-5-(4-methoxyphenyl)-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione
| Molecular Formula | C25H22N2O5 |
|---|---|
| Molecular Weight | 430.15 g/mol |
| LogP | 3.7207 |
| Topological Polar Surface Area | 88.96 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 430.15286 |
| Heavy Atoms | 32 |
| Complexity | 1172.4514 |
Chemical Identifiers
| CAS Number | 609312-89-2 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2/C(=C(/C3=CC(=CC=C3)OC)\O)/C(=O)C(=O)N2CC4=CN=CC=C4 |
Product Overview
AB00802749-01 (CAS 609312-89-2), with molecular formula C25H22N2O5 and molecular weight 430.15 g/mol. IUPAC: (4E)-4-[hydroxy-(3-methoxyphenyl)methylidene]-5-(4-methoxyphenyl)-1-(pyridin-3-ylmethyl)pyrrolidine-2,3-dione.
Chemical Property Profile of AB00802749-01
Property Insights of AB00802749-01
The XLogP value of 3.7207 indicates that AB00802749-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.96 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00802749-01. Following Lipinski's Rule of Five, AB00802749-01 has 1 hydrogen bond donor(s) and 6 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 AB00802749-01?
The CAS number of AB00802749-01 is 609312-89-2.
What is the molecular formula of AB00802749-01?
The molecular formula of AB00802749-01 is C25H22N2O5.
What is the molecular weight of AB00802749-01?
The molecular weight of AB00802749-01 is 430.15 g/mol.
Where can I buy AB00802749-01?
You can request a quote for AB00802749-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00802749-01?
Yes, KEHONG BIO provides custom synthesis services for AB00802749-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.