1-Amino-2-bromo-4-(3-chloroanilino)anthraquinone
TL;DR: 1-Amino-2-bromo-4-(3-chloroanilino)anthraquinone (CAS 52222-30-7) is a chemical compound with molecular formula C20H12BrClN2O2 and molecular weight 425.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-amino-2-bromo-4-(3-chloroanilino)anthracene-9,10-dione
Also Known As: 1-Amino-2-bromo-4-(3-chloroanilino)anthraquinone, 1-amino-2-bromo-4- anthraquinone, 1-amino-2-bromo-4-(3-chloroanilino)anthracene-9,10-dione, 1-amino-2-bromo-4-((3-chlorophenyl)amino)anthracene-9,10-dione, 1-amino-2-bromo-4-[(3-chlorophenyl)amino]-9,10-anthraquinone
| Molecular Formula | C20H12BrClN2O2 |
|---|---|
| Molecular Weight | 425.98 g/mol |
| LogP | 6.2 |
| Topological Polar Surface Area | 72.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 425.97708 |
| Heavy Atoms | 26 |
| Complexity | 574.0 |
Chemical Identifiers
| CAS Number | 52222-30-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3NC4=CC(=CC=C4)Cl)Br)N |
| InChIKey | MHCBWGDHCLKTPC-UHFFFAOYSA-N |
Product Overview
1-Amino-2-bromo-4-(3-chloroanilino)anthraquinone (CAS 52222-30-7), with molecular formula C20H12BrClN2O2 and molecular weight 425.98 g/mol. IUPAC: 1-amino-2-bromo-4-(3-chloroanilino)anthracene-9,10-dione.
Chemical Property Profile of 1-Amino-2-bromo-4-(3-chloroanilino)anthraquinone
Property Insights of 1-Amino-2-bromo-4-(3-chloroanilino)anthraquinone
The XLogP value of 6.2 indicates that 1-Amino-2-bromo-4-(3-chloroanilino)anthraquinone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Amino-2-bromo-4-(3-chloroanilino)anthraquinone. Following Lipinski's Rule of Five, 1-Amino-2-bromo-4-(3-chloroanilino)anthraquinone has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-Amino-2-bromo-4-(3-chloroanilino)anthraquinone?
The CAS number of 1-Amino-2-bromo-4-(3-chloroanilino)anthraquinone is 52222-30-7.
What is the molecular formula of 1-Amino-2-bromo-4-(3-chloroanilino)anthraquinone?
The molecular formula of 1-Amino-2-bromo-4-(3-chloroanilino)anthraquinone is C20H12BrClN2O2.
What is the molecular weight of 1-Amino-2-bromo-4-(3-chloroanilino)anthraquinone?
The molecular weight of 1-Amino-2-bromo-4-(3-chloroanilino)anthraquinone is 425.98 g/mol.
Where can I buy 1-Amino-2-bromo-4-(3-chloroanilino)anthraquinone?
You can request a quote for 1-Amino-2-bromo-4-(3-chloroanilino)anthraquinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Amino-2-bromo-4-(3-chloroanilino)anthraquinone?
Yes, KEHONG BIO provides custom synthesis services for 1-Amino-2-bromo-4-(3-chloroanilino)anthraquinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.