AN-648/15596004
TL;DR: AN-648/15596004 (CAS 428824-85-5) is a chemical compound with molecular formula C16H11BrN2O3 and molecular weight 358.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4Z)-1-(4-bromophenyl)-4-[(E)-3-(furan-2-yl)prop-2-enylidene]pyrazolidine-3,5-dione
Also Known As: AN-648/15596004, (4Z)-1-(4-bromophenyl)-4-[(E)-3-(furan-2-yl)prop-2-enylidene]pyrazolidine-3,5-dione, 1-(4-bromophenyl)-4-[3-(2-furyl)-2-propenylidene]-3,5-pyrazolidinedione, (4Z)-1-(4-BROMOPHENYL)-4-[(2E)-3-(FURAN-2-YL)PROP-2-EN-1-YLIDENE]PYRAZOLIDINE-3,5-DIONE
| Molecular Formula | C16H11BrN2O3 |
|---|---|
| Molecular Weight | 358.00 g/mol |
| LogP | 3.0597 |
| Topological Polar Surface Area | 62.55 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 357.9953 |
| Heavy Atoms | 22 |
| Complexity | 761.1984 |
Chemical Identifiers
| CAS Number | 428824-85-5 |
|---|---|
| SMILES | C1=COC(=C1)/C=C/C=C\2/C(=O)NN(C2=O)C3=CC=C(C=C3)Br |
Product Overview
AN-648/15596004 (CAS 428824-85-5), with molecular formula C16H11BrN2O3 and molecular weight 358.00 g/mol. IUPAC: (4Z)-1-(4-bromophenyl)-4-[(E)-3-(furan-2-yl)prop-2-enylidene]pyrazolidine-3,5-dione.
Chemical Property Profile of AN-648/15596004
Property Insights of AN-648/15596004
The XLogP value of 3.0597 indicates that AN-648/15596004 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.55 Ų falls within the moderate polarity range, balancing permeability and solubility for AN-648/15596004. Following Lipinski's Rule of Five, AN-648/15596004 has 1 hydrogen bond donor(s) and 3 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 AN-648/15596004?
The CAS number of AN-648/15596004 is 428824-85-5.
What is the molecular formula of AN-648/15596004?
The molecular formula of AN-648/15596004 is C16H11BrN2O3.
What is the molecular weight of AN-648/15596004?
The molecular weight of AN-648/15596004 is 358.00 g/mol.
Where can I buy AN-648/15596004?
You can request a quote for AN-648/15596004 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AN-648/15596004?
Yes, KEHONG BIO provides custom synthesis services for AN-648/15596004 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.