4-[imidazol-1-yl(phenyl)methyl]-1,5-diphenylpyrazole

C25H20N4 — CID 3012922

IUPAC4-[imidazol-1-yl(phenyl)methyl]-1,5-diphenylpyrazole
SMILESc1ccc(-c2c(C(c3ccccc3)n3ccnc3)cnn2-c2ccccc2)cc1
InChIInChI=1S/C25H20N4/c1-4-10-20(11-5-1)24(28-17-16-26-19-28)23-18-27-29(22-14-8-3-9-15-22)25(23)21-12-6-2-7-13-21/h1-19,24H
InChIKeyYLBFPIYXAWBZAL-UHFFFAOYSA-N
MW376.46 g/mol
LogP5.37
Rot. Bonds5

About 4-[imidazol-1-yl(phenyl)methyl]-1,5-diphenylpyrazole

4-[imidazol-1-yl(phenyl)methyl]-1,5-diphenylpyrazole (PubChem CID 3012922) has the molecular formula C25H20N4 and a molecular weight of 376.46 g/mol. Its IUPAC name is 4-[imidazol-1-yl(phenyl)methyl]-1,5-diphenylpyrazole.

Molecular Properties

Compound Name4-[imidazol-1-yl(phenyl)methyl]-1,5-diphenylpyrazole
PubChem CID3012922
Molecular FormulaC25H20N4
Molecular Weight376.46 g/mol
Exact Mass376.17
IUPAC Name4-[imidazol-1-yl(phenyl)methyl]-1,5-diphenylpyrazole
SMILESc1ccc(-c2c(C(c3ccccc3)n3ccnc3)cnn2-c2ccccc2)cc1
InChIInChI=1S/C25H20N4/c1-4-10-20(11-5-1)24(28-17-16-26-19-28)23-18-27-29(22-14-8-3-9-15-22)25(23)21-12-6-2-7-13-21/h1-19,24H
InChIKeyYLBFPIYXAWBZAL-UHFFFAOYSA-N
XLogP5.37
TPSA35.64 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500376.46
LogP ≤ 55.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 4-[imidazol-1-yl(phenyl)methyl]-1,5-diphenylpyrazole 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 4-[imidazol-1-yl(phenyl)methyl]-1,5-diphenylpyrazole?
The IUPAC name of 4-[imidazol-1-yl(phenyl)methyl]-1,5-diphenylpyrazole (CID 3012922) is 4-[imidazol-1-yl(phenyl)methyl]-1,5-diphenylpyrazole.
What is the SMILES notation for 4-[imidazol-1-yl(phenyl)methyl]-1,5-diphenylpyrazole?
The canonical SMILES for 4-[imidazol-1-yl(phenyl)methyl]-1,5-diphenylpyrazole is c1ccc(-c2c(C(c3ccccc3)n3ccnc3)cnn2-c2ccccc2)cc1.
What is the InChIKey of 4-[imidazol-1-yl(phenyl)methyl]-1,5-diphenylpyrazole?
The InChIKey is YLBFPIYXAWBZAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H20N4/c1-4-10-20(11-5-1)24(28-17-16-26-19-28)23-18-27-29(22-14-8-3-9-15-22)25(23)21-12-6-2-7-13-21/h1-19,24H.
What are the key properties of 4-[imidazol-1-yl(phenyl)methyl]-1,5-diphenylpyrazole?
4-[imidazol-1-yl(phenyl)methyl]-1,5-diphenylpyrazole has a molecular weight of 376.46 g/mol, XLogP of 5.37, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[imidazol-1-yl(phenyl)methyl]-1,5-diphenylpyrazole is sourced from PubChem (CID 3012922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).