C25H22BrNO5
TL;DR: C25H22BrNO5 (CAS 859665-98-8) is a chemical compound with molecular formula C25H22BrNO5 and molecular weight 495.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(6-bromo-2-oxochromen-3-yl)-7-hydroxy-8-[(4-methylpiperidin-1-yl)methyl]chromen-2-one
Also Known As: 4-(6-bromo-2-oxo-chromen-3-yl)-7-hydroxy-8-[(4-methyl-1-piperidyl)methyl]chromen-2-one, 4-(6-bromo-2-oxochromen-3-yl)-7-hydroxy-8-[(4-methylpiperidin-1-yl)methyl]chromen-2-one, 6-bromo-3-{7-hydroxy-8-[(4-methylpiperidyl)methyl]-2-oxochromen-4-yl}chromen-2 -one, 6-bromo-7'-hydroxy-8'-((4-methylpiperidin-1-yl)methyl)-2H,2'H-[3,4'-bichromene]-2,2'-dione, 6-bromo-7'-hydroxy-8'-[(4-methylpiperidin-1-yl)methyl]-2H,2'H-3,4'-bichromene-2,2'-dione
| Molecular Formula | C25H22BrNO5 |
|---|---|
| Molecular Weight | 495.07 g/mol |
| LogP | 5.2664 |
| Topological Polar Surface Area | 83.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 495.06815 |
| Heavy Atoms | 32 |
| Complexity | 1446.9485 |
Chemical Identifiers
| CAS Number | 859665-98-8 |
|---|---|
| SMILES | CC1CCN(CC1)CC2=C(C=CC3=C2OC(=O)C=C3C4=CC5=C(C=CC(=C5)Br)OC4=O)O |
Product Overview
C25H22BrNO5 (CAS 859665-98-8), with molecular formula C25H22BrNO5 and molecular weight 495.07 g/mol. IUPAC: 4-(6-bromo-2-oxochromen-3-yl)-7-hydroxy-8-[(4-methylpiperidin-1-yl)methyl]chromen-2-one.
Chemical Property Profile of C25H22BrNO5
Property Insights of C25H22BrNO5
The XLogP value of 5.2664 indicates that C25H22BrNO5 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.89 Ų falls within the moderate polarity range, balancing permeability and solubility for C25H22BrNO5. Following Lipinski's Rule of Five, C25H22BrNO5 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of C25H22BrNO5?
The CAS number of C25H22BrNO5 is 859665-98-8.
What is the molecular formula of C25H22BrNO5?
The molecular formula of C25H22BrNO5 is C25H22BrNO5.
What is the molecular weight of C25H22BrNO5?
The molecular weight of C25H22BrNO5 is 495.07 g/mol.
Where can I buy C25H22BrNO5?
You can request a quote for C25H22BrNO5 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C25H22BrNO5?
Yes, KEHONG BIO provides custom synthesis services for C25H22BrNO5 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.