Acenaphthenequinone thiosemicarbazone
TL;DR: Acenaphthenequinone thiosemicarbazone (CAS 95264-76-9) is a chemical compound with molecular formula C13H9N3OS and molecular weight 255.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2-oxoacenaphthylen-1-ylidene)amino]thiourea
Also Known As: AQ-TSC, acenaphthenequinone thiosemicarbazone, [(2-oxoacenaphthylen-1-ylidene)amino]thiourea, Hydrazinecarbothioamide, 2-(2-oxo-1(2H)-acenaphthylenylidene)-, 1-(1-oxoacenaphthylen-2(1h)-ylidene amino)isothiourea
| Molecular Formula | C13H9N3OS |
|---|---|
| Molecular Weight | 255.05 g/mol |
| LogP | 1.5734 |
| Topological Polar Surface Area | 67.48 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 255.04663 |
| Heavy Atoms | 18 |
| Complexity | 715.99817 |
Chemical Identifiers
| CAS Number | 95264-76-9 |
|---|---|
| SMILES | C1=CC2=C3C(=C1)C(=NNC(=S)N)C(=O)C3=CC=C2 |
Product Overview
Acenaphthenequinone thiosemicarbazone (CAS 95264-76-9), with molecular formula C13H9N3OS and molecular weight 255.05 g/mol. IUPAC: [(2-oxoacenaphthylen-1-ylidene)amino]thiourea.
Chemical Property Profile of Acenaphthenequinone thiosemicarbazone
Property Insights of Acenaphthenequinone thiosemicarbazone
The XLogP value of 1.5734 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acenaphthenequinone thiosemicarbazone. The TPSA of 67.48 Ų falls within the moderate polarity range, balancing permeability and solubility for Acenaphthenequinone thiosemicarbazone. Following Lipinski's Rule of Five, Acenaphthenequinone thiosemicarbazone has 2 hydrogen bond donor(s) and 3 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 Acenaphthenequinone thiosemicarbazone?
The CAS number of Acenaphthenequinone thiosemicarbazone is 95264-76-9.
What is the molecular formula of Acenaphthenequinone thiosemicarbazone?
The molecular formula of Acenaphthenequinone thiosemicarbazone is C13H9N3OS.
What is the molecular weight of Acenaphthenequinone thiosemicarbazone?
The molecular weight of Acenaphthenequinone thiosemicarbazone is 255.05 g/mol.
Where can I buy Acenaphthenequinone thiosemicarbazone?
You can request a quote for Acenaphthenequinone thiosemicarbazone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acenaphthenequinone thiosemicarbazone?
Yes, KEHONG BIO provides custom synthesis services for Acenaphthenequinone thiosemicarbazone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.