1,8-Diamino-9,10-anthracenedione
TL;DR: 1,8-Diamino-9,10-anthracenedione (CAS 129-42-0) is a chemical compound with molecular formula C14H10N2O2 and molecular weight 238.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,8-diaminoanthracene-9,10-dione
Also Known As: 1,8-DIAMINOANTHRAQUINONE, 1,8-Anthraquinonyldiamine, 1,8-diaminoanthracene-9,10-dione, 1,8-Diaminoanthrachinon, 1,8-Diamino-anthraquinone
| Molecular Formula | C14H10N2O2 |
|---|---|
| Molecular Weight | 238.07 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 86.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 238.07423 |
| Heavy Atoms | 18 |
| Complexity | 350.0 |
Chemical Identifiers
| CAS Number | 129-42-0 |
|---|---|
| SMILES | C1=CC2=C(C(=C1)N)C(=O)C3=C(C2=O)C=CC=C3N |
| InChIKey | QWXDVWSEUJXVIK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,8-Diamino-9,10-anthracenedione (CAS 129-42-0), with molecular formula C14H10N2O2 and molecular weight 238.07 g/mol. IUPAC: 1,8-diaminoanthracene-9,10-dione.
Chemical Property Profile of 1,8-Diamino-9,10-anthracenedione
Property Insights of 1,8-Diamino-9,10-anthracenedione
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,8-Diamino-9,10-anthracenedione. The TPSA of 86.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,8-Diamino-9,10-anthracenedione. Following Lipinski's Rule of Five, 1,8-Diamino-9,10-anthracenedione 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 1,8-Diamino-9,10-anthracenedione?
The CAS number of 1,8-Diamino-9,10-anthracenedione is 129-42-0.
What is the molecular formula of 1,8-Diamino-9,10-anthracenedione?
The molecular formula of 1,8-Diamino-9,10-anthracenedione is C14H10N2O2.
What is the molecular weight of 1,8-Diamino-9,10-anthracenedione?
The molecular weight of 1,8-Diamino-9,10-anthracenedione is 238.07 g/mol.
Where can I buy 1,8-Diamino-9,10-anthracenedione?
You can request a quote for 1,8-Diamino-9,10-anthracenedione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,8-Diamino-9,10-anthracenedione?
Yes, KEHONG BIO provides custom synthesis services for 1,8-Diamino-9,10-anthracenedione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.