![2-[(E)-1-(4-fluorophenyl)ethylidene]-1-hydrazinecarbothioamide structure](/static/products/7771/777-16-2.webp)
2-[(E)-1-(4-fluorophenyl)ethylidene]-1-hydrazinecarbothioamide
TL;DR: 2-[(E)-1-(4-fluorophenyl)ethylidene]-1-hydrazinecarbothioamide (CAS 777-16-2) is a chemical compound with molecular formula C9H10FN3S and molecular weight 211.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-(4-fluorophenyl)ethylideneamino]thiourea
Also Known As: [1-(4-fluorophenyl)ethylideneamino]thiourea|KS-000021I5|2-[(E)-1-(4-fluorophenyl)ethylidene]-1-hydrazinecarbothioamide|{[1-(4-fluorophenyl)ethylidene]amino}thiourea|1-(1-(4-fluorophenyl)ethylidene)thiosemicarbazide|[1-(4-FLUOROPHENYL)ETHYLIDENE]AMINOTHIOUREA|(Z)-2-(1-(4-fluorophenyl)ethylidene)hydrazinecarbothioamide|2-[1-(4-Fluorophenyl)ethylidene]hydrazine-1-carboximidothioic acid
| Molecular Formula | C9H10FN3S |
|---|---|
| Molecular Weight | 211.06 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 82.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 211.05795 |
| Heavy Atoms | 14 |
| Complexity | 234.0 |
Chemical Identifiers
| CAS Number | 777-16-2 |
|---|---|
| SMILES | CC(=NNC(=S)N)C1=CC=C(C=C1)F |
| InChIKey | JBOMIBNEKCISGH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-[(E)-1-(4-fluorophenyl)ethylidene]-1-hydrazinecarbothioamide (CAS 777-16-2), with molecular formula C9H10FN3S and molecular weight 211.06 g/mol. IUPAC: [1-(4-fluorophenyl)ethylideneamino]thiourea.
Chemical Property Profile of 2-[(E)-1-(4-fluorophenyl)ethylidene]-1-hydrazinecarbothioamide
Property Insights of 2-[(E)-1-(4-fluorophenyl)ethylidene]-1-hydrazinecarbothioamide
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(E)-1-(4-fluorophenyl)ethylidene]-1-hydrazinecarbothioamide. The TPSA of 82.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(E)-1-(4-fluorophenyl)ethylidene]-1-hydrazinecarbothioamide. Following Lipinski's Rule of Five, 2-[(E)-1-(4-fluorophenyl)ethylidene]-1-hydrazinecarbothioamide 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 2-[(E)-1-(4-fluorophenyl)ethylidene]-1-hydrazinecarbothioamide?
The CAS number of 2-[(E)-1-(4-fluorophenyl)ethylidene]-1-hydrazinecarbothioamide is 777-16-2.
What is the molecular formula of 2-[(E)-1-(4-fluorophenyl)ethylidene]-1-hydrazinecarbothioamide?
The molecular formula of 2-[(E)-1-(4-fluorophenyl)ethylidene]-1-hydrazinecarbothioamide is C9H10FN3S.
What is the molecular weight of 2-[(E)-1-(4-fluorophenyl)ethylidene]-1-hydrazinecarbothioamide?
The molecular weight of 2-[(E)-1-(4-fluorophenyl)ethylidene]-1-hydrazinecarbothioamide is 211.06 g/mol.
Where can I buy 2-[(E)-1-(4-fluorophenyl)ethylidene]-1-hydrazinecarbothioamide?
You can request a quote for 2-[(E)-1-(4-fluorophenyl)ethylidene]-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)-1-(4-fluorophenyl)ethylidene]-1-hydrazinecarbothioamide?
Yes, KEHONG BIO provides custom synthesis services for 2-[(E)-1-(4-fluorophenyl)ethylidene]-1-hydrazinecarbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.