2-[(4-Fluorophenyl)methylene]-N-methylhydrazinecarbothioamide
TL;DR: 2-[(4-Fluorophenyl)methylene]-N-methylhydrazinecarbothioamide (CAS 301201-62-7) 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-[(E)-(4-fluorophenyl)methylideneamino]-3-methylthiourea
Also Known As: J2.519.265F, 4-Methyl-1-(4-fluorobenzylidene)thiosemicarbazide, 2-[(4-Fluorophenyl)methylene]-N-methylhydrazinecarbothioamide, 1-[(E)-(4-fluorophenyl)methyleneamino]-3-methyl-thiourea, 1-[(E)-(4-fluorophenyl)methylideneamino]-3-methylthiourea
| Molecular Formula | C9H10FN3S |
|---|---|
| Molecular Weight | 211.06 g/mol |
| LogP | 1.2535 |
| Topological Polar Surface Area | 36.42 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 211.05795 |
| Heavy Atoms | 14 |
| Complexity | 334.41522 |
Chemical Identifiers
| CAS Number | 301201-62-7 |
|---|---|
| SMILES | CNC(=S)N/N=C/C1=CC=C(C=C1)F |
Product Overview
2-[(4-Fluorophenyl)methylene]-N-methylhydrazinecarbothioamide (CAS 301201-62-7), with molecular formula C9H10FN3S and molecular weight 211.06 g/mol. IUPAC: 1-[(E)-(4-fluorophenyl)methylideneamino]-3-methylthiourea.
Chemical Property Profile of 2-[(4-Fluorophenyl)methylene]-N-methylhydrazinecarbothioamide
Property Insights of 2-[(4-Fluorophenyl)methylene]-N-methylhydrazinecarbothioamide
The XLogP value of 1.2535 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(4-Fluorophenyl)methylene]-N-methylhydrazinecarbothioamide. With a topological polar surface area (TPSA) of 36.42 Ų, 2-[(4-Fluorophenyl)methylene]-N-methylhydrazinecarbothioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(4-Fluorophenyl)methylene]-N-methylhydrazinecarbothioamide has 2 hydrogen bond donor(s) and 2 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-[(4-Fluorophenyl)methylene]-N-methylhydrazinecarbothioamide?
The CAS number of 2-[(4-Fluorophenyl)methylene]-N-methylhydrazinecarbothioamide is 301201-62-7.
What is the molecular formula of 2-[(4-Fluorophenyl)methylene]-N-methylhydrazinecarbothioamide?
The molecular formula of 2-[(4-Fluorophenyl)methylene]-N-methylhydrazinecarbothioamide is C9H10FN3S.
What is the molecular weight of 2-[(4-Fluorophenyl)methylene]-N-methylhydrazinecarbothioamide?
The molecular weight of 2-[(4-Fluorophenyl)methylene]-N-methylhydrazinecarbothioamide is 211.06 g/mol.
Where can I buy 2-[(4-Fluorophenyl)methylene]-N-methylhydrazinecarbothioamide?
You can request a quote for 2-[(4-Fluorophenyl)methylene]-N-methylhydrazinecarbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(4-Fluorophenyl)methylene]-N-methylhydrazinecarbothioamide?
Yes, KEHONG BIO provides custom synthesis services for 2-[(4-Fluorophenyl)methylene]-N-methylhydrazinecarbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.