RefChem:82726
TL;DR: RefChem:82726 (CAS 63450-49-7) is a chemical compound with molecular formula C25H22ClN3O2 and molecular weight 431.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[4-[4-(4-methoxyanilino)anilino]phenyl]iminocyclohexa-2,5-dien-1-one;hydrochloride
Also Known As: 2,5-Cyclohexadien-1-one, 4-((4-((4-((4-methoxyphenyl)amino)phenyl)amino)phenyl)imino)-, hydrochloride, 2,5-Cyclohexadien-1-one, 4-((4-((4-((4-methoxyphenyl)amino)phenyl)amino)phenyl)imino)-, hydrochloride (1:?), 2,5-Cyclohexadien-1-one, 4-[[4-[[4-[(4-methoxyphenyl)amino]phenyl]amino]phenyl]imino]-, hydrochloride, 4-((4-((4-((4-Methoxyphenyl)amino)phenyl)amino)phenyl)imino)-2,5-cyclohexadien-1-one, hydrochloride, 4-[4-[4-(4-methoxyanilino)anilino]phenyl]iminocyclohexa-2,5-dien-1-one hydrochloride
| Molecular Formula | C25H22ClN3O2 |
|---|---|
| Molecular Weight | 431.14 g/mol |
| LogP | 6.3718 |
| Topological Polar Surface Area | 62.72 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 431.14005 |
| Heavy Atoms | 31 |
| Complexity | 1098.9385 |
Chemical Identifiers
| CAS Number | 63450-49-7 |
|---|---|
| SMILES | COC1=CC=C(C=C1)NC2=CC=C(C=C2)NC3=CC=C(C=C3)N=C4C=CC(=O)C=C4.Cl |
Product Overview
RefChem:82726 (CAS 63450-49-7), with molecular formula C25H22ClN3O2 and molecular weight 431.14 g/mol. IUPAC: 4-[4-[4-(4-methoxyanilino)anilino]phenyl]iminocyclohexa-2,5-dien-1-one;hydrochloride.
Chemical Property Profile of RefChem:82726
Property Insights of RefChem:82726
The XLogP value of 6.3718 indicates that RefChem:82726 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.72 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:82726. Following Lipinski's Rule of Five, RefChem:82726 has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:82726?
The CAS number of RefChem:82726 is 63450-49-7.
What is the molecular formula of RefChem:82726?
The molecular formula of RefChem:82726 is C25H22ClN3O2.
What is the molecular weight of RefChem:82726?
The molecular weight of RefChem:82726 is 431.14 g/mol.
Where can I buy RefChem:82726?
You can request a quote for RefChem:82726 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:82726?
Yes, KEHONG BIO provides custom synthesis services for RefChem:82726 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.