BAS 01296652
TL;DR: BAS 01296652 (CAS 309724-55-8) is a chemical compound with molecular formula C26H29NO8 and molecular weight 483.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[(3E)-2-(3,4-dimethoxyphenyl)-3-[hydroxy-(4-methoxyphenyl)methylidene]-4,5-dioxopyrrolidin-1-yl]hexanoic acid
Also Known As: BAS 01296652, A2217/0093350, 6-[2-(3,4-dimethoxyphenyl)-4-hydroxy-3-(4-methoxybenzoyl)-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]hexanoic acid, 6-(2-(3,4-dimethoxyphenyl)-4-hydroxy-3-(4-methoxybenzoyl)-5-oxo-2,5-dihydro-1H-pyrrol-1-yl)hexanoic acid, 6-[(3E)-2-(3,4-dimethoxyphenyl)-3-[hydroxy-(4-methoxyphenyl)methylidene]-4,5-dioxopyrrolidin-1-yl]hexanoic acid
| Molecular Formula | C26H29NO8 |
|---|---|
| Molecular Weight | 483.19 g/mol |
| LogP | 3.7791 |
| Topological Polar Surface Area | 122.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 11 |
| Exact Mass | 483.18933 |
| Heavy Atoms | 35 |
| Complexity | 1122.6718 |
Chemical Identifiers
| CAS Number | 309724-55-8 |
|---|---|
| SMILES | COC1=CC=C(C=C1)/C(=C\2/C(N(C(=O)C2=O)CCCCCC(=O)O)C3=CC(=C(C=C3)OC)OC)/O |
Product Overview
BAS 01296652 (CAS 309724-55-8), with molecular formula C26H29NO8 and molecular weight 483.19 g/mol. IUPAC: 6-[(3E)-2-(3,4-dimethoxyphenyl)-3-[hydroxy-(4-methoxyphenyl)methylidene]-4,5-dioxopyrrolidin-1-yl]hexanoic acid.
Chemical Property Profile of BAS 01296652
Property Insights of BAS 01296652
The XLogP value of 3.7791 indicates that BAS 01296652 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 122.6 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01296652. Following Lipinski's Rule of Five, BAS 01296652 has 2 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 BAS 01296652?
The CAS number of BAS 01296652 is 309724-55-8.
What is the molecular formula of BAS 01296652?
The molecular formula of BAS 01296652 is C26H29NO8.
What is the molecular weight of BAS 01296652?
The molecular weight of BAS 01296652 is 483.19 g/mol.
Where can I buy BAS 01296652?
You can request a quote for BAS 01296652 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01296652?
Yes, KEHONG BIO provides custom synthesis services for BAS 01296652 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.