BIM-0012822.P001
TL;DR: BIM-0012822.P001 (CAS 347375-59-1) is a chemical compound with molecular formula C21H18O5 and molecular weight 350.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-methoxy-4-[(E)-[5-(4-methylphenyl)-2-oxofuran-3-ylidene]methyl]phenyl] acetate
Also Known As: BIM-0012822.P001, 2-methoxy-4-{(E)-[5-(4-methylphenyl)-2-oxofuran-3(2H)-ylidene]methyl}phenyl acetate, [2-methoxy-4-[(E)-[5-(4-methylphenyl)-2-oxofuran-3-ylidene]methyl]phenyl] acetate, (E)-2-methoxy-4-((2-oxo-5-(p-tolyl)furan-3(2H)-ylidene)methyl)phenyl acetate, 2-methoxy-4-{[5-(4-methylphenyl)-2-oxo-3(2H)-furanylidene]methyl}phenyl acetate
| Molecular Formula | C21H18O5 |
|---|---|
| Molecular Weight | 350.12 g/mol |
| LogP | 3.91022 |
| Topological Polar Surface Area | 61.83 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 350.11542 |
| Heavy Atoms | 26 |
| Complexity | 919.91766 |
Chemical Identifiers
| CAS Number | 347375-59-1 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=C/C(=C\C3=CC(=C(C=C3)OC(=O)C)OC)/C(=O)O2 |
Product Overview
BIM-0012822.P001 (CAS 347375-59-1), with molecular formula C21H18O5 and molecular weight 350.12 g/mol. IUPAC: [2-methoxy-4-[(E)-[5-(4-methylphenyl)-2-oxofuran-3-ylidene]methyl]phenyl] acetate.
Chemical Property Profile of BIM-0012822.P001
Property Insights of BIM-0012822.P001
The XLogP value of 3.91022 indicates that BIM-0012822.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.83 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0012822.P001. Following Lipinski's Rule of Five, BIM-0012822.P001 has 0 hydrogen bond donor(s) and 5 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-0012822.P001?
The CAS number of BIM-0012822.P001 is 347375-59-1.
What is the molecular formula of BIM-0012822.P001?
The molecular formula of BIM-0012822.P001 is C21H18O5.
What is the molecular weight of BIM-0012822.P001?
The molecular weight of BIM-0012822.P001 is 350.12 g/mol.
Where can I buy BIM-0012822.P001?
You can request a quote for BIM-0012822.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0012822.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0012822.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.