1-Amino-4-bromo-2-(hydroxymethyl)anthraquinone
TL;DR: 1-Amino-4-bromo-2-(hydroxymethyl)anthraquinone (CAS 24094-46-0) is a chemical compound with molecular formula C15H10BrNO3 and molecular weight 330.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-amino-4-bromo-2-(hydroxymethyl)anthracene-9,10-dione
Also Known As: 1-Amino-4-bromo-2- anthraquinone, 1-Amino-4-bromo-2-(hydroxymethyl)anthraquinone, 1-amino-4-bromo-2-(hydroxymethyl)anthracene-9,10-dione, 1-Amino-4-brom-2-(hydroxymethyl)anthrachinon, 1-Amino-2-(hydroxymethyl)-4-bromoanthraquinone
| Molecular Formula | C15H10BrNO3 |
|---|---|
| Molecular Weight | 330.98 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 80.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 330.9844 |
| Heavy Atoms | 20 |
| Complexity | 427.0 |
Chemical Identifiers
| CAS Number | 24094-46-0 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)C3=C(C=C(C(=C3C2=O)N)CO)Br |
| InChIKey | VACUZNZYZQMQTD-UHFFFAOYSA-N |
Product Overview
1-Amino-4-bromo-2-(hydroxymethyl)anthraquinone (CAS 24094-46-0), with molecular formula C15H10BrNO3 and molecular weight 330.98 g/mol. IUPAC: 1-amino-4-bromo-2-(hydroxymethyl)anthracene-9,10-dione.
Chemical Property Profile of 1-Amino-4-bromo-2-(hydroxymethyl)anthraquinone
Property Insights of 1-Amino-4-bromo-2-(hydroxymethyl)anthraquinone
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Amino-4-bromo-2-(hydroxymethyl)anthraquinone. The TPSA of 80.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Amino-4-bromo-2-(hydroxymethyl)anthraquinone. Following Lipinski's Rule of Five, 1-Amino-4-bromo-2-(hydroxymethyl)anthraquinone has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-Amino-4-bromo-2-(hydroxymethyl)anthraquinone?
The CAS number of 1-Amino-4-bromo-2-(hydroxymethyl)anthraquinone is 24094-46-0.
What is the molecular formula of 1-Amino-4-bromo-2-(hydroxymethyl)anthraquinone?
The molecular formula of 1-Amino-4-bromo-2-(hydroxymethyl)anthraquinone is C15H10BrNO3.
What is the molecular weight of 1-Amino-4-bromo-2-(hydroxymethyl)anthraquinone?
The molecular weight of 1-Amino-4-bromo-2-(hydroxymethyl)anthraquinone is 330.98 g/mol.
Where can I buy 1-Amino-4-bromo-2-(hydroxymethyl)anthraquinone?
You can request a quote for 1-Amino-4-bromo-2-(hydroxymethyl)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-bromo-2-(hydroxymethyl)anthraquinone?
Yes, KEHONG BIO provides custom synthesis services for 1-Amino-4-bromo-2-(hydroxymethyl)anthraquinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.