5-[(2-fluorophenyl)diazenyl]-4-phenyl-1,3-thiazol-2-amine

C15H11FN4S — CID 135672336

IUPAC5-[(2-fluorophenyl)diazenyl]-4-phenyl-1,3-thiazol-2-amine
SMILESNc1nc(-c2ccccc2)c(/N=N/c2ccccc2F)s1
InChIInChI=1S/C15H11FN4S/c16-11-8-4-5-9-12(11)19-20-14-13(18-15(17)21-14)10-6-2-1-3-7-10/h1-9H,(H2,17,18)/b20-19+
InChIKeyLENGXPFBAXKYFT-FMQUCBEESA-N
MW298.35 g/mol
LogP4.95
Rot. Bonds3

About 5-[(2-fluorophenyl)diazenyl]-4-phenyl-1,3-thiazol-2-amine

5-[(2-fluorophenyl)diazenyl]-4-phenyl-1,3-thiazol-2-amine (PubChem CID 135672336) has the molecular formula C15H11FN4S and a molecular weight of 298.35 g/mol. Its IUPAC name is 5-[(2-fluorophenyl)diazenyl]-4-phenyl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-[(2-fluorophenyl)diazenyl]-4-phenyl-1,3-thiazol-2-amine
PubChem CID135672336
Molecular FormulaC15H11FN4S
Molecular Weight298.35 g/mol
Exact Mass298.07
IUPAC Name5-[(2-fluorophenyl)diazenyl]-4-phenyl-1,3-thiazol-2-amine
SMILESNc1nc(-c2ccccc2)c(/N=N/c2ccccc2F)s1
InChIInChI=1S/C15H11FN4S/c16-11-8-4-5-9-12(11)19-20-14-13(18-15(17)21-14)10-6-2-1-3-7-10/h1-9H,(H2,17,18)/b20-19+
InChIKeyLENGXPFBAXKYFT-FMQUCBEESA-N
XLogP4.95
TPSA63.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.35
LogP ≤ 54.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}

Analyze 5-[(2-fluorophenyl)diazenyl]-4-phenyl-1,3-thiazol-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-[(2-fluorophenyl)diazenyl]-4-phenyl-1,3-thiazol-2-amine?
The IUPAC name of 5-[(2-fluorophenyl)diazenyl]-4-phenyl-1,3-thiazol-2-amine (CID 135672336) is 5-[(2-fluorophenyl)diazenyl]-4-phenyl-1,3-thiazol-2-amine.
What is the SMILES notation for 5-[(2-fluorophenyl)diazenyl]-4-phenyl-1,3-thiazol-2-amine?
The canonical SMILES for 5-[(2-fluorophenyl)diazenyl]-4-phenyl-1,3-thiazol-2-amine is Nc1nc(-c2ccccc2)c(/N=N/c2ccccc2F)s1.
What is the InChIKey of 5-[(2-fluorophenyl)diazenyl]-4-phenyl-1,3-thiazol-2-amine?
The InChIKey is LENGXPFBAXKYFT-FMQUCBEESA-N. The full InChI is InChI=1S/C15H11FN4S/c16-11-8-4-5-9-12(11)19-20-14-13(18-15(17)21-14)10-6-2-1-3-7-10/h1-9H,(H2,17,18)/b20-19+.
What are the key properties of 5-[(2-fluorophenyl)diazenyl]-4-phenyl-1,3-thiazol-2-amine?
5-[(2-fluorophenyl)diazenyl]-4-phenyl-1,3-thiazol-2-amine has a molecular weight of 298.35 g/mol, XLogP of 4.95, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2-fluorophenyl)diazenyl]-4-phenyl-1,3-thiazol-2-amine is sourced from PubChem (CID 135672336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).