[(E)-(2-fluorophenyl)methyleneamino]thiourea
TL;DR: [(E)-(2-fluorophenyl)methyleneamino]thiourea (CAS 2107-16-6) is a chemical compound with molecular formula C8H8FN3S and molecular weight 197.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(E)-(2-fluorophenyl)methylideneamino]thiourea
Also Known As: 2-fluorobenzaldehyde thiosemicarbazone, [(E)-(2-fluorophenyl)methyleneamino]thiourea, 1-[(2-Fluorobenzylidene)amino]thiourea, {[(2-fluorophenyl)methylidene]amino}thiourea, J1.108.608J
| Molecular Formula | C8H8FN3S |
|---|---|
| Molecular Weight | 197.04 g/mol |
| LogP | 0.9928 |
| Topological Polar Surface Area | 50.41 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 197.0423 |
| Heavy Atoms | 13 |
| Complexity | 337.91595 |
Chemical Identifiers
| CAS Number | 2107-16-6 |
|---|---|
| SMILES | C1=CC=C(C(=C1)/C=N/NC(=S)N)F |
Product Overview
[(E)-(2-fluorophenyl)methyleneamino]thiourea (CAS 2107-16-6), with molecular formula C8H8FN3S and molecular weight 197.04 g/mol. IUPAC: [(E)-(2-fluorophenyl)methylideneamino]thiourea.
Chemical Property Profile of [(E)-(2-fluorophenyl)methyleneamino]thiourea
Property Insights of [(E)-(2-fluorophenyl)methyleneamino]thiourea
The XLogP value of 0.9928 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(E)-(2-fluorophenyl)methyleneamino]thiourea. With a topological polar surface area (TPSA) of 50.41 Ų, [(E)-(2-fluorophenyl)methyleneamino]thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [(E)-(2-fluorophenyl)methyleneamino]thiourea 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 [(E)-(2-fluorophenyl)methyleneamino]thiourea?
The CAS number of [(E)-(2-fluorophenyl)methyleneamino]thiourea is 2107-16-6.
What is the molecular formula of [(E)-(2-fluorophenyl)methyleneamino]thiourea?
The molecular formula of [(E)-(2-fluorophenyl)methyleneamino]thiourea is C8H8FN3S.
What is the molecular weight of [(E)-(2-fluorophenyl)methyleneamino]thiourea?
The molecular weight of [(E)-(2-fluorophenyl)methyleneamino]thiourea is 197.04 g/mol.
Where can I buy [(E)-(2-fluorophenyl)methyleneamino]thiourea?
You can request a quote for [(E)-(2-fluorophenyl)methyleneamino]thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(E)-(2-fluorophenyl)methyleneamino]thiourea?
Yes, KEHONG BIO provides custom synthesis services for [(E)-(2-fluorophenyl)methyleneamino]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.