1,4-Diamino-2,3-anthraquinonedicarboximide
TL;DR: 1,4-Diamino-2,3-anthraquinonedicarboximide (CAS 128-81-4) is a chemical compound with molecular formula C16H9N3O4 and molecular weight 307.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,11-diaminonaphtho[2,3-f]isoindole-1,3,5,10-tetrone
Also Known As: 1,3-dicarboximide, 1,3-anthraquinonedicarboximide, 1,4-Diamino-2,3-anthraquinonedicarboximide, 4,11-Diamino-1H-naphth[2,3-f]isoindole-1,3,5,10(2H)-tetrone, 4,11-diaminonaphtho[2,3-f]isoindole-1,3,5,10-tetrone
| Molecular Formula | C16H9N3O4 |
|---|---|
| Molecular Weight | 307.06 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 132.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 307.0593 |
| Heavy Atoms | 23 |
| Complexity | 566.0 |
Chemical Identifiers
| CAS Number | 128-81-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C4C(=C3N)C(=O)NC4=O)N |
| InChIKey | UOBRDAVIVQKFCM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,4-Diamino-2,3-anthraquinonedicarboximide (CAS 128-81-4), with molecular formula C16H9N3O4 and molecular weight 307.06 g/mol. IUPAC: 4,11-diaminonaphtho[2,3-f]isoindole-1,3,5,10-tetrone.
Chemical Property Profile of 1,4-Diamino-2,3-anthraquinonedicarboximide
Property Insights of 1,4-Diamino-2,3-anthraquinonedicarboximide
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,4-Diamino-2,3-anthraquinonedicarboximide. The TPSA of 132.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,4-Diamino-2,3-anthraquinonedicarboximide. Following Lipinski's Rule of Five, 1,4-Diamino-2,3-anthraquinonedicarboximide has 3 hydrogen bond donor(s) and 6 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-Diamino-2,3-anthraquinonedicarboximide?
The CAS number of 1,4-Diamino-2,3-anthraquinonedicarboximide is 128-81-4.
What is the molecular formula of 1,4-Diamino-2,3-anthraquinonedicarboximide?
The molecular formula of 1,4-Diamino-2,3-anthraquinonedicarboximide is C16H9N3O4.
What is the molecular weight of 1,4-Diamino-2,3-anthraquinonedicarboximide?
The molecular weight of 1,4-Diamino-2,3-anthraquinonedicarboximide is 307.06 g/mol.
Where can I buy 1,4-Diamino-2,3-anthraquinonedicarboximide?
You can request a quote for 1,4-Diamino-2,3-anthraquinonedicarboximide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Diamino-2,3-anthraquinonedicarboximide?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Diamino-2,3-anthraquinonedicarboximide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.