1-(2-Hydroxy-5-bromo-benzylidene)thiosemicarbazide
TL;DR: 1-(2-Hydroxy-5-bromo-benzylidene)thiosemicarbazide (CAS 16434-32-5) is a chemical compound with molecular formula C8H8BrN3OS and molecular weight 272.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(5-bromo-2-hydroxyphenyl)methylideneamino]thiourea
Also Known As: 5-bromo-2-hydroxybenzaldehyde thiosemicarbazone, 1-(2-hydroxy-5-bromo-benzylidene)thiosemicarbazide, 2-[(5-bromo-2-hydroxyphenyl)methylene]hydrazine-1-carbothioamide, Hydrazinecarbothioamide, 2-[(5-bromo-2-hydroxyphenyl)methylene]-, HYDRAZINECARBOTHIOAMIDE,2-[(5-BROMO-2-HYDROXYPHENYL)METHYLENE]-
| Molecular Formula | C8H8BrN3OS |
|---|---|
| Molecular Weight | 272.96 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 103.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 272.95715 |
| Heavy Atoms | 14 |
| Complexity | 237.0 |
Chemical Identifiers
| CAS Number | 16434-32-5 |
|---|---|
| SMILES | C1=CC(=C(C=C1Br)C=NNC(=S)N)O |
| InChIKey | AMZRNDJCSNFEHY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(2-Hydroxy-5-bromo-benzylidene)thiosemicarbazide (CAS 16434-32-5), with molecular formula C8H8BrN3OS and molecular weight 272.96 g/mol. IUPAC: [(5-bromo-2-hydroxyphenyl)methylideneamino]thiourea.
Chemical Property Profile of 1-(2-Hydroxy-5-bromo-benzylidene)thiosemicarbazide
Property Insights of 1-(2-Hydroxy-5-bromo-benzylidene)thiosemicarbazide
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2-Hydroxy-5-bromo-benzylidene)thiosemicarbazide. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2-Hydroxy-5-bromo-benzylidene)thiosemicarbazide. Following Lipinski's Rule of Five, 1-(2-Hydroxy-5-bromo-benzylidene)thiosemicarbazide 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 1-(2-Hydroxy-5-bromo-benzylidene)thiosemicarbazide?
The CAS number of 1-(2-Hydroxy-5-bromo-benzylidene)thiosemicarbazide is 16434-32-5.
What is the molecular formula of 1-(2-Hydroxy-5-bromo-benzylidene)thiosemicarbazide?
The molecular formula of 1-(2-Hydroxy-5-bromo-benzylidene)thiosemicarbazide is C8H8BrN3OS.
What is the molecular weight of 1-(2-Hydroxy-5-bromo-benzylidene)thiosemicarbazide?
The molecular weight of 1-(2-Hydroxy-5-bromo-benzylidene)thiosemicarbazide is 272.96 g/mol.
Where can I buy 1-(2-Hydroxy-5-bromo-benzylidene)thiosemicarbazide?
You can request a quote for 1-(2-Hydroxy-5-bromo-benzylidene)thiosemicarbazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-Hydroxy-5-bromo-benzylidene)thiosemicarbazide?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Hydroxy-5-bromo-benzylidene)thiosemicarbazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.