BIM-0041938.P001
TL;DR: BIM-0041938.P001 (CAS 128944-29-6) is a chemical compound with molecular formula C21H22N2O6 and molecular weight 398.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(E)-2-[2-(3,4-dimethoxyphenyl)ethylamino]prop-1-enyl]-3-nitro-1-benzofuran-5-ol
Also Known As: BIM-0041938.P001, 2-[(E)-2-[2-(3,4-dimethoxyphenyl)ethylamino]prop-1-enyl]-3-nitro-1-benzofuran-5-ol, AH-262/34226041, 2-(2-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-1-propenyl)-3-nitro-1-benzofuran-5-ol, (E)-2-(2-((3,4-dimethoxyphenethyl)amino)prop-1-en-1-yl)-3-nitrobenzofuran-5-ol
| Molecular Formula | C21H22N2O6 |
|---|---|
| Molecular Weight | 398.15 g/mol |
| LogP | 4.2569 |
| Topological Polar Surface Area | 107.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 398.1478 |
| Heavy Atoms | 29 |
| Complexity | 1070.4637 |
Chemical Identifiers
| CAS Number | 128944-29-6 |
|---|---|
| SMILES | C/C(=C\C1=C(C2=C(O1)C=CC(=C2)O)[N+](=O)[O-])/NCCC3=CC(=C(C=C3)OC)OC |
Product Overview
BIM-0041938.P001 (CAS 128944-29-6), with molecular formula C21H22N2O6 and molecular weight 398.15 g/mol. IUPAC: 2-[(E)-2-[2-(3,4-dimethoxyphenyl)ethylamino]prop-1-enyl]-3-nitro-1-benzofuran-5-ol.
Chemical Property Profile of BIM-0041938.P001
Property Insights of BIM-0041938.P001
The XLogP value of 4.2569 indicates that BIM-0041938.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 107.0 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0041938.P001. Following Lipinski's Rule of Five, BIM-0041938.P001 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 BIM-0041938.P001?
The CAS number of BIM-0041938.P001 is 128944-29-6.
What is the molecular formula of BIM-0041938.P001?
The molecular formula of BIM-0041938.P001 is C21H22N2O6.
What is the molecular weight of BIM-0041938.P001?
The molecular weight of BIM-0041938.P001 is 398.15 g/mol.
Where can I buy BIM-0041938.P001?
You can request a quote for BIM-0041938.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0041938.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0041938.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.