2-[(E)-(3-bromo-2-hydroxy-5-methoxyphenyl)methylidene]-1-hydrazinecarbothioamide
TL;DR: 2-[(E)-(3-bromo-2-hydroxy-5-methoxyphenyl)methylidene]-1-hydrazinecarbothioamide (CAS 477848-19-4) is a chemical compound with molecular formula C9H10BrN3O2S and molecular weight 302.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(3-bromo-2-hydroxy-5-methoxyphenyl)methylideneamino]thiourea
Also Known As: 2-[(E)-(3-bromo-2-hydroxy-5-methoxyphenyl)methylidene]-1-hydrazinecarbothioamide
| Molecular Formula | C9H10BrN3O2S |
|---|---|
| Molecular Weight | 302.97 g/mol |
| LogP | 1.3304 |
| Topological Polar Surface Area | 79.87 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 302.9677 |
| Heavy Atoms | 16 |
| Complexity | 437.00742 |
Chemical Identifiers
| CAS Number | 477848-19-4 |
|---|---|
| SMILES | COC1=CC(=C(C(=C1)Br)O)C=NNC(=S)N |
Product Overview
2-[(E)-(3-bromo-2-hydroxy-5-methoxyphenyl)methylidene]-1-hydrazinecarbothioamide (CAS 477848-19-4), with molecular formula C9H10BrN3O2S and molecular weight 302.97 g/mol. IUPAC: [(3-bromo-2-hydroxy-5-methoxyphenyl)methylideneamino]thiourea.
Chemical Property Profile of 2-[(E)-(3-bromo-2-hydroxy-5-methoxyphenyl)methylidene]-1-hydrazinecarbothioamide
Property Insights of 2-[(E)-(3-bromo-2-hydroxy-5-methoxyphenyl)methylidene]-1-hydrazinecarbothioamide
The XLogP value of 1.3304 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(E)-(3-bromo-2-hydroxy-5-methoxyphenyl)methylidene]-1-hydrazinecarbothioamide. The TPSA of 79.87 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(E)-(3-bromo-2-hydroxy-5-methoxyphenyl)methylidene]-1-hydrazinecarbothioamide. Following Lipinski's Rule of Five, 2-[(E)-(3-bromo-2-hydroxy-5-methoxyphenyl)methylidene]-1-hydrazinecarbothioamide 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-[(E)-(3-bromo-2-hydroxy-5-methoxyphenyl)methylidene]-1-hydrazinecarbothioamide?
The CAS number of 2-[(E)-(3-bromo-2-hydroxy-5-methoxyphenyl)methylidene]-1-hydrazinecarbothioamide is 477848-19-4.
What is the molecular formula of 2-[(E)-(3-bromo-2-hydroxy-5-methoxyphenyl)methylidene]-1-hydrazinecarbothioamide?
The molecular formula of 2-[(E)-(3-bromo-2-hydroxy-5-methoxyphenyl)methylidene]-1-hydrazinecarbothioamide is C9H10BrN3O2S.
What is the molecular weight of 2-[(E)-(3-bromo-2-hydroxy-5-methoxyphenyl)methylidene]-1-hydrazinecarbothioamide?
The molecular weight of 2-[(E)-(3-bromo-2-hydroxy-5-methoxyphenyl)methylidene]-1-hydrazinecarbothioamide is 302.97 g/mol.
Where can I buy 2-[(E)-(3-bromo-2-hydroxy-5-methoxyphenyl)methylidene]-1-hydrazinecarbothioamide?
You can request a quote for 2-[(E)-(3-bromo-2-hydroxy-5-methoxyphenyl)methylidene]-1-hydrazinecarbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(E)-(3-bromo-2-hydroxy-5-methoxyphenyl)methylidene]-1-hydrazinecarbothioamide?
Yes, KEHONG BIO provides custom synthesis services for 2-[(E)-(3-bromo-2-hydroxy-5-methoxyphenyl)methylidene]-1-hydrazinecarbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.