1-Amino-4-((3-chlorophenyl)amino)-2-(ethylsulphonyl)anthraquinone
TL;DR: 1-Amino-4-((3-chlorophenyl)amino)-2-(ethylsulphonyl)anthraquinone (CAS 28252-15-5) is a chemical compound with molecular formula C22H17ClN2O4S and molecular weight 440.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-amino-4-(3-chloroanilino)-2-ethylsulfonylanthracene-9,10-dione
Also Known As: 3-aminobenzaldehyde,m-aminobenzaldehyde, 1-Amino-4-((3-chlorophenyl)amino)-2-(ethylsulphonyl)anthraquinone, 1-Amino-4-((3-chlorophenyl)amino)-2-(ethylsulfonyl)anthracene-9,10-dione, Anthraquinone, 1-amino-4-(m-chloroanilino)-2-(ethylsulfonyl)-, 1-Amino-4-((3-chlorophenyl)amino)-2-(ethylsulfonyl)anthraquinone
| Molecular Formula | C22H17ClN2O4S |
|---|---|
| Molecular Weight | 440.06 g/mol |
| LogP | 5.1 |
| Topological Polar Surface Area | 115.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 440.05975 |
| Heavy Atoms | 30 |
| Complexity | 782.0 |
Chemical Identifiers
| CAS Number | 28252-15-5 |
|---|---|
| SMILES | CCS(=O)(=O)C1=C(C2=C(C(=C1)NC3=CC(=CC=C3)Cl)C(=O)C4=CC=CC=C4C2=O)N |
| InChIKey | YXIFYSPDGDPJEM-UHFFFAOYSA-N |
Product Overview
1-Amino-4-((3-chlorophenyl)amino)-2-(ethylsulphonyl)anthraquinone (CAS 28252-15-5), with molecular formula C22H17ClN2O4S and molecular weight 440.06 g/mol. IUPAC: 1-amino-4-(3-chloroanilino)-2-ethylsulfonylanthracene-9,10-dione.
Chemical Property Profile of 1-Amino-4-((3-chlorophenyl)amino)-2-(ethylsulphonyl)anthraquinone
Property Insights of 1-Amino-4-((3-chlorophenyl)amino)-2-(ethylsulphonyl)anthraquinone
The XLogP value of 5.1 indicates that 1-Amino-4-((3-chlorophenyl)amino)-2-(ethylsulphonyl)anthraquinone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 115.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Amino-4-((3-chlorophenyl)amino)-2-(ethylsulphonyl)anthraquinone. Following Lipinski's Rule of Five, 1-Amino-4-((3-chlorophenyl)amino)-2-(ethylsulphonyl)anthraquinone has 2 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 1-Amino-4-((3-chlorophenyl)amino)-2-(ethylsulphonyl)anthraquinone?
The CAS number of 1-Amino-4-((3-chlorophenyl)amino)-2-(ethylsulphonyl)anthraquinone is 28252-15-5.
What is the molecular formula of 1-Amino-4-((3-chlorophenyl)amino)-2-(ethylsulphonyl)anthraquinone?
The molecular formula of 1-Amino-4-((3-chlorophenyl)amino)-2-(ethylsulphonyl)anthraquinone is C22H17ClN2O4S.
What is the molecular weight of 1-Amino-4-((3-chlorophenyl)amino)-2-(ethylsulphonyl)anthraquinone?
The molecular weight of 1-Amino-4-((3-chlorophenyl)amino)-2-(ethylsulphonyl)anthraquinone is 440.06 g/mol.
Where can I buy 1-Amino-4-((3-chlorophenyl)amino)-2-(ethylsulphonyl)anthraquinone?
You can request a quote for 1-Amino-4-((3-chlorophenyl)amino)-2-(ethylsulphonyl)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-4-((3-chlorophenyl)amino)-2-(ethylsulphonyl)anthraquinone?
Yes, KEHONG BIO provides custom synthesis services for 1-Amino-4-((3-chlorophenyl)amino)-2-(ethylsulphonyl)anthraquinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.