BAS 01815171
TL;DR: BAS 01815171 (CAS 6042-43-9) is a chemical compound with molecular formula C25H26N2O9 and molecular weight 498.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[2-(2,4-dimethoxyphenyl)-3-[hydroxy-(4-nitrophenyl)methylidene]-4,5-dioxopyrrolidin-1-yl]hexanoic acid
Also Known As: BAS 01815171, 6-[(3E)-2-(2,4-dimethoxyphenyl)-3-[hydroxy-(4-nitrophenyl)methylidene]-4,5-dioxo-pyrrolidin-1-yl]hexanoic acid, 6-[2-(2,4-dimethoxyphenyl)-3-[hydroxy-(4-nitrophenyl)methylidene]-4,5-dioxopyrrolidin-1-yl]hexanoic acid
| Molecular Formula | C25H26N2O9 |
|---|---|
| Molecular Weight | 498.16 g/mol |
| LogP | 3.6787 |
| Topological Polar Surface Area | 156.51 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 11 |
| Exact Mass | 498.16382 |
| Heavy Atoms | 36 |
| Complexity | 1204.5106 |
Chemical Identifiers
| CAS Number | 6042-43-9 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)C2C(=C(C3=CC=C(C=C3)[N+](=O)[O-])O)C(=O)C(=O)N2CCCCCC(=O)O)OC |
Product Overview
BAS 01815171 (CAS 6042-43-9), with molecular formula C25H26N2O9 and molecular weight 498.16 g/mol. IUPAC: 6-[2-(2,4-dimethoxyphenyl)-3-[hydroxy-(4-nitrophenyl)methylidene]-4,5-dioxopyrrolidin-1-yl]hexanoic acid.
Chemical Property Profile of BAS 01815171
Property Insights of BAS 01815171
The XLogP value of 3.6787 indicates that BAS 01815171 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 156.51 Ų indicates high polarity, suggesting BAS 01815171 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, BAS 01815171 has 2 hydrogen bond donor(s) and 8 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 01815171?
The CAS number of BAS 01815171 is 6042-43-9.
What is the molecular formula of BAS 01815171?
The molecular formula of BAS 01815171 is C25H26N2O9.
What is the molecular weight of BAS 01815171?
The molecular weight of BAS 01815171 is 498.16 g/mol.
Where can I buy BAS 01815171?
You can request a quote for BAS 01815171 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01815171?
Yes, KEHONG BIO provides custom synthesis services for BAS 01815171 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.