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2-[(4-Fluorophenyl)methyl]-1H-1,3-benzodiazol-5-amine structure
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2-[(4-Fluorophenyl)methyl]-1H-1,3-benzodiazol-5-amine

TL;DR: 2-[(4-Fluorophenyl)methyl]-1H-1,3-benzodiazol-5-amine (CAS 108281-62-5) is a chemical compound with molecular formula C14H12FN3 and molecular weight 241.10153 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-[(4-fluorophenyl)methyl]-3H-benzimidazol-5-amine

Also Known As: ASN 12893290, 2-[(4-FLUOROPHENYL)METHYL]-1H-1,3-BENZODIAZOL-5-AMINE, 2-(4-Fluoro-benzyl)-1H-benzoimidazol-5-ylamine, 2-(4-Fluorobenzyl)-1h-benzo[d]imidazol-5-amine, 2-(4-fluorophenyl)methyl-1H-1,3-benzodiazol-5-amine

CAS Number
108281-62-5
Molecular Formula
C14H12FN3
Molecular Weight
241.10153 g/mol
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Technical Specifications

Molecular FormulaC14H12FN3
Molecular Weight241.10153 g/mol
XLogP2.9
Topological Polar Surface Area (TPSA)54.7 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors3
Rotatable Bonds2
Exact Mass241.10153 Da
Heavy Atoms18
Complexity278.0
SMILESC1=CC(=CC=C1CC2=NC3=C(N2)C=C(C=C3)N)F
InChIKeyWCVOJAQWNPNHMH-UHFFFAOYSA-N

Chemical Property Profile of 2-[(4-Fluorophenyl)methyl]-1H-1,3-benzodiazol-5-amine

XLogP
2.9
TPSA (Topological Polar Surface Area)
54.7
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
3
Rotatable Bonds
2
Heavy Atoms
18
Complexity
278.0
Exact Mass
241.10153
Monoisotopic Mass
241.10153
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 2-[(4-Fluorophenyl)methyl]-1H-1,3-benzodiazol-5-amine

The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(4-Fluorophenyl)methyl]-1H-1,3-benzodiazol-5-amine. With a topological polar surface area (TPSA) of 54.7 Ų, 2-[(4-Fluorophenyl)methyl]-1H-1,3-benzodiazol-5-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(4-Fluorophenyl)methyl]-1H-1,3-benzodiazol-5-amine 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

What is the CAS number of 2-[(4-Fluorophenyl)methyl]-1H-1,3-benzodiazol-5-amine?

The CAS number of 2-[(4-Fluorophenyl)methyl]-1H-1,3-benzodiazol-5-amine is 108281-62-5.

What is the molecular formula of 2-[(4-Fluorophenyl)methyl]-1H-1,3-benzodiazol-5-amine?

The molecular formula of 2-[(4-Fluorophenyl)methyl]-1H-1,3-benzodiazol-5-amine is C14H12FN3.

What is the molecular weight of 2-[(4-Fluorophenyl)methyl]-1H-1,3-benzodiazol-5-amine?

The molecular weight of 2-[(4-Fluorophenyl)methyl]-1H-1,3-benzodiazol-5-amine is 241.10153 g/mol.

Where can I buy 2-[(4-Fluorophenyl)methyl]-1H-1,3-benzodiazol-5-amine?

You can request a quote for 2-[(4-Fluorophenyl)methyl]-1H-1,3-benzodiazol-5-amine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 2-[(4-Fluorophenyl)methyl]-1H-1,3-benzodiazol-5-amine?

Yes, CoreyChem provides custom synthesis services for 2-[(4-Fluorophenyl)methyl]-1H-1,3-benzodiazol-5-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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