1,4,5-Triaminoanthraquinone
TL;DR: 1,4,5-Triaminoanthraquinone (CAS 6407-69-8) is a chemical compound with molecular formula C14H11N3O2 and molecular weight 253.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,4,5-triaminoanthracene-9,10-dione
Also Known As: 1,4,5-Triaminoanthraquinone, 1,4,5-triaminoanthracene-9,10-dione, 1,4,5-Triamino-anthrachinon, EINECS 229-037-2, Anthraquinone, 1,4,5-triamino-
| Molecular Formula | C14H11N3O2 |
|---|---|
| Molecular Weight | 253.09 g/mol |
| LogP | 1.2086 |
| Topological Polar Surface Area | 112.2 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 253.08513 |
| Heavy Atoms | 19 |
| Complexity | 750.59656 |
Chemical Identifiers
| CAS Number | 6407-69-8 |
|---|---|
| SMILES | C1=CC2=C(C(=C1)N)C(=O)C3=C(C=CC(=C3C2=O)N)N |
Product Overview
1,4,5-Triaminoanthraquinone (CAS 6407-69-8), with molecular formula C14H11N3O2 and molecular weight 253.09 g/mol. IUPAC: 1,4,5-triaminoanthracene-9,10-dione.
Chemical Property Profile of 1,4,5-Triaminoanthraquinone
Property Insights of 1,4,5-Triaminoanthraquinone
The XLogP value of 1.2086 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,4,5-Triaminoanthraquinone. The TPSA of 112.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,4,5-Triaminoanthraquinone. Following Lipinski's Rule of Five, 1,4,5-Triaminoanthraquinone has 3 hydrogen bond donor(s) and 5 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 1,4,5-Triaminoanthraquinone?
The CAS number of 1,4,5-Triaminoanthraquinone is 6407-69-8.
What is the molecular formula of 1,4,5-Triaminoanthraquinone?
The molecular formula of 1,4,5-Triaminoanthraquinone is C14H11N3O2.
What is the molecular weight of 1,4,5-Triaminoanthraquinone?
The molecular weight of 1,4,5-Triaminoanthraquinone is 253.09 g/mol.
Where can I buy 1,4,5-Triaminoanthraquinone?
You can request a quote for 1,4,5-Triaminoanthraquinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4,5-Triaminoanthraquinone?
Yes, KEHONG BIO provides custom synthesis services for 1,4,5-Triaminoanthraquinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.