![3-{[4-({3-bromo-2-hydroxy-5-nitrobenzylidene}amino)phenyl]imino}-2-phenyl-1-indanone structure](/static/products/4168/416873-28-4.webp)
3-{[4-({3-bromo-2-hydroxy-5-nitrobenzylidene}amino)phenyl]imino}-2-phenyl-1-indanone
TL;DR: 3-{[4-({3-bromo-2-hydroxy-5-nitrobenzylidene}amino)phenyl]imino}-2-phenyl-1-indanone (CAS 416873-28-4) is a chemical compound with molecular formula C28H18BrN3O4 and molecular weight 539.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-[(3-bromo-2-hydroxy-5-nitrophenyl)methylideneamino]phenyl]imino-2-phenylinden-1-one
Also Known As: 3-{[4-({3-bromo-2-hydroxy-5-nitrobenzylidene}amino)phenyl]imino}-2-phenyl-1-indanone, 3-[4-[(3-bromo-2-hydroxy-5-nitrophenyl)methylideneamino]phenyl]imino-2-phenylinden-1-one, (E)-3-((4-((E)-(3-bromo-2-hydroxy-5-nitrobenzylidene)amino)phenyl)imino)-2-phenyl-2,3-dihydro-1H-inden-1-one, 3-[4-[(5-bromo-3-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]phenyl]imino-2-phenylinden-1-one, 3-[4-[[(E)-(5-bromo-3-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]phenyl]imino-2-phenylinden-1-one
| Molecular Formula | C28H18BrN3O4 |
|---|---|
| Molecular Weight | 539.05 g/mol |
| LogP | 6.9144 |
| Topological Polar Surface Area | 105.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 539.0481 |
| Heavy Atoms | 36 |
| Complexity | 1547.3257 |
Chemical Identifiers
| CAS Number | 416873-28-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2C(=NC3=CC=C(C=C3)N=CC4=C(C(=CC(=C4)[N+](=O)[O-])Br)O)C5=CC=CC=C5C2=O |
Product Overview
3-{[4-({3-bromo-2-hydroxy-5-nitrobenzylidene}amino)phenyl]imino}-2-phenyl-1-indanone (CAS 416873-28-4), with molecular formula C28H18BrN3O4 and molecular weight 539.05 g/mol. IUPAC: 3-[4-[(3-bromo-2-hydroxy-5-nitrophenyl)methylideneamino]phenyl]imino-2-phenylinden-1-one.
Chemical Property Profile of 3-{[4-({3-bromo-2-hydroxy-5-nitrobenzylidene}amino)phenyl]imino}-2-phenyl-1-indanone
Property Insights of 3-{[4-({3-bromo-2-hydroxy-5-nitrobenzylidene}amino)phenyl]imino}-2-phenyl-1-indanone
The XLogP value of 6.9144 indicates that 3-{[4-({3-bromo-2-hydroxy-5-nitrobenzylidene}amino)phenyl]imino}-2-phenyl-1-indanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 105.16 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-{[4-({3-bromo-2-hydroxy-5-nitrobenzylidene}amino)phenyl]imino}-2-phenyl-1-indanone. Following Lipinski's Rule of Five, 3-{[4-({3-bromo-2-hydroxy-5-nitrobenzylidene}amino)phenyl]imino}-2-phenyl-1-indanone 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 3-{[4-({3-bromo-2-hydroxy-5-nitrobenzylidene}amino)phenyl]imino}-2-phenyl-1-indanone?
The CAS number of 3-{[4-({3-bromo-2-hydroxy-5-nitrobenzylidene}amino)phenyl]imino}-2-phenyl-1-indanone is 416873-28-4.
What is the molecular formula of 3-{[4-({3-bromo-2-hydroxy-5-nitrobenzylidene}amino)phenyl]imino}-2-phenyl-1-indanone?
The molecular formula of 3-{[4-({3-bromo-2-hydroxy-5-nitrobenzylidene}amino)phenyl]imino}-2-phenyl-1-indanone is C28H18BrN3O4.
What is the molecular weight of 3-{[4-({3-bromo-2-hydroxy-5-nitrobenzylidene}amino)phenyl]imino}-2-phenyl-1-indanone?
The molecular weight of 3-{[4-({3-bromo-2-hydroxy-5-nitrobenzylidene}amino)phenyl]imino}-2-phenyl-1-indanone is 539.05 g/mol.
Where can I buy 3-{[4-({3-bromo-2-hydroxy-5-nitrobenzylidene}amino)phenyl]imino}-2-phenyl-1-indanone?
You can request a quote for 3-{[4-({3-bromo-2-hydroxy-5-nitrobenzylidene}amino)phenyl]imino}-2-phenyl-1-indanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-{[4-({3-bromo-2-hydroxy-5-nitrobenzylidene}amino)phenyl]imino}-2-phenyl-1-indanone?
Yes, KEHONG BIO provides custom synthesis services for 3-{[4-({3-bromo-2-hydroxy-5-nitrobenzylidene}amino)phenyl]imino}-2-phenyl-1-indanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.