5-Chlorosalicylaldehyde thiosemicarbazone
TL;DR: 5-Chlorosalicylaldehyde thiosemicarbazone (CAS 20234-13-3) is a chemical compound with molecular formula C8H8ClN3OS and molecular weight 229.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(5-chloro-2-hydroxyphenyl)methylideneamino]thiourea
Also Known As: 5-chlorosalicylaldehyde thiosemicarbazone, 2-[(5-Chloro-2-hydroxyphenyl)methylene]hydrazinecarbothioamide, [[(E)-(3-chloro-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]ami, 2-[(5-Chloro-2-hydroxyphenyl)methylidene]hydrazine-1-carbothioamide, Hydrazinecarbothioamide, 2-[(5-chloro-2-hydroxyphenyl)methylene]-
| Molecular Formula | C8H8ClN3OS |
|---|---|
| Molecular Weight | 229.01 g/mol |
| LogP | 1.2127 |
| Topological Polar Surface Area | 70.64 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 229.00766 |
| Heavy Atoms | 14 |
| Complexity | 380.84918 |
Chemical Identifiers
| CAS Number | 20234-13-3 |
|---|---|
| SMILES | C1=CC(=C(C=C1Cl)C=NNC(=S)N)O |
Product Overview
5-Chlorosalicylaldehyde thiosemicarbazone (CAS 20234-13-3), with molecular formula C8H8ClN3OS and molecular weight 229.01 g/mol. IUPAC: [(5-chloro-2-hydroxyphenyl)methylideneamino]thiourea.
Chemical Property Profile of 5-Chlorosalicylaldehyde thiosemicarbazone
Property Insights of 5-Chlorosalicylaldehyde thiosemicarbazone
The XLogP value of 1.2127 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Chlorosalicylaldehyde thiosemicarbazone. The TPSA of 70.64 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Chlorosalicylaldehyde thiosemicarbazone. Following Lipinski's Rule of Five, 5-Chlorosalicylaldehyde thiosemicarbazone has 3 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 5-Chlorosalicylaldehyde thiosemicarbazone?
The CAS number of 5-Chlorosalicylaldehyde thiosemicarbazone is 20234-13-3.
What is the molecular formula of 5-Chlorosalicylaldehyde thiosemicarbazone?
The molecular formula of 5-Chlorosalicylaldehyde thiosemicarbazone is C8H8ClN3OS.
What is the molecular weight of 5-Chlorosalicylaldehyde thiosemicarbazone?
The molecular weight of 5-Chlorosalicylaldehyde thiosemicarbazone is 229.01 g/mol.
Where can I buy 5-Chlorosalicylaldehyde thiosemicarbazone?
You can request a quote for 5-Chlorosalicylaldehyde thiosemicarbazone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Chlorosalicylaldehyde thiosemicarbazone?
Yes, KEHONG BIO provides custom synthesis services for 5-Chlorosalicylaldehyde thiosemicarbazone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.