2,5-Diamino-1,4-naphthoquinone imine
TL;DR: 2,5-Diamino-1,4-naphthoquinone imine (CAS 60599-33-9) is a chemical compound with molecular formula C10H9N3O and molecular weight 187.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5-diamino-4-iminonaphthalen-1-one
Also Known As: 2,5-Diamino-1,4-naphthoquinone imine, 2,5-Diamino-1,4-napthoquinone imine, 2,5-Diamino-4-imino-1(4H)-naphthalenone, 2,5-diamino-4-iminonaphthalen-1-one, 1(4H)-NAPHTHALENONE, 2,5-DIAMINO-4-IMINO-
| Molecular Formula | C10H9N3O |
|---|---|
| Molecular Weight | 187.07 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 93.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 187.07455 |
| Heavy Atoms | 14 |
| Complexity | 321.0 |
Chemical Identifiers
| CAS Number | 60599-33-9 |
|---|---|
| SMILES | C1=CC2=C(C(=C1)N)C(=N)C=C(C2=O)N |
| InChIKey | FHPXUGNPLJQXOF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,5-Diamino-1,4-naphthoquinone imine (CAS 60599-33-9), with molecular formula C10H9N3O and molecular weight 187.07 g/mol. IUPAC: 2,5-diamino-4-iminonaphthalen-1-one.
Chemical Property Profile of 2,5-Diamino-1,4-naphthoquinone imine
Property Insights of 2,5-Diamino-1,4-naphthoquinone imine
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,5-Diamino-1,4-naphthoquinone imine. The TPSA of 93.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,5-Diamino-1,4-naphthoquinone imine. Following Lipinski's Rule of Five, 2,5-Diamino-1,4-naphthoquinone imine has 3 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 2,5-Diamino-1,4-naphthoquinone imine?
The CAS number of 2,5-Diamino-1,4-naphthoquinone imine is 60599-33-9.
What is the molecular formula of 2,5-Diamino-1,4-naphthoquinone imine?
The molecular formula of 2,5-Diamino-1,4-naphthoquinone imine is C10H9N3O.
What is the molecular weight of 2,5-Diamino-1,4-naphthoquinone imine?
The molecular weight of 2,5-Diamino-1,4-naphthoquinone imine is 187.07 g/mol.
Where can I buy 2,5-Diamino-1,4-naphthoquinone imine?
You can request a quote for 2,5-Diamino-1,4-naphthoquinone imine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5-Diamino-1,4-naphthoquinone imine?
Yes, KEHONG BIO provides custom synthesis services for 2,5-Diamino-1,4-naphthoquinone imine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.