4-[5-(4-fluorophenyl)-2-phenyl-3,4-dihydropyrazol-3-yl]-1,3-diphenylpyrazole

C30H23FN4 — CID 15890048

IUPAC4-[5-(4-fluorophenyl)-2-phenyl-3,4-dihydropyrazol-3-yl]-1,3-diphenylpyrazole
SMILESFc1ccc(C2=NN(c3ccccc3)C(c3cn(-c4ccccc4)nc3-c3ccccc3)C2)cc1
InChIInChI=1S/C30H23FN4/c31-24-18-16-22(17-19-24)28-20-29(35(32-28)26-14-8-3-9-15-26)27-21-34(25-12-6-2-7-13-25)33-30(27)23-10-4-1-5-11-23/h1-19,21,29H,20H2
InChIKeyJZDSFNNZPFBPBW-UHFFFAOYSA-N
MW458.54 g/mol
LogP7.03
Rot. Bonds5

About 4-[5-(4-fluorophenyl)-2-phenyl-3,4-dihydropyrazol-3-yl]-1,3-diphenylpyrazole

4-[5-(4-fluorophenyl)-2-phenyl-3,4-dihydropyrazol-3-yl]-1,3-diphenylpyrazole (PubChem CID 15890048) has the molecular formula C30H23FN4 and a molecular weight of 458.54 g/mol. Its IUPAC name is 4-[5-(4-fluorophenyl)-2-phenyl-3,4-dihydropyrazol-3-yl]-1,3-diphenylpyrazole.

Molecular Properties

Compound Name4-[5-(4-fluorophenyl)-2-phenyl-3,4-dihydropyrazol-3-yl]-1,3-diphenylpyrazole
PubChem CID15890048
Molecular FormulaC30H23FN4
Molecular Weight458.54 g/mol
Exact Mass458.19
IUPAC Name4-[5-(4-fluorophenyl)-2-phenyl-3,4-dihydropyrazol-3-yl]-1,3-diphenylpyrazole
SMILESFc1ccc(C2=NN(c3ccccc3)C(c3cn(-c4ccccc4)nc3-c3ccccc3)C2)cc1
InChIInChI=1S/C30H23FN4/c31-24-18-16-22(17-19-24)28-20-29(35(32-28)26-14-8-3-9-15-26)27-21-34(25-12-6-2-7-13-25)33-30(27)23-10-4-1-5-11-23/h1-19,21,29H,20H2
InChIKeyJZDSFNNZPFBPBW-UHFFFAOYSA-N
XLogP7.03
TPSA33.42 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500458.54
LogP ≤ 57.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 4-[5-(4-fluorophenyl)-2-phenyl-3,4-dihydropyrazol-3-yl]-1,3-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-[5-(4-fluorophenyl)-2-phenyl-3,4-dihydropyrazol-3-yl]-1,3-diphenylpyrazole?
The IUPAC name of 4-[5-(4-fluorophenyl)-2-phenyl-3,4-dihydropyrazol-3-yl]-1,3-diphenylpyrazole (CID 15890048) is 4-[5-(4-fluorophenyl)-2-phenyl-3,4-dihydropyrazol-3-yl]-1,3-diphenylpyrazole.
What is the SMILES notation for 4-[5-(4-fluorophenyl)-2-phenyl-3,4-dihydropyrazol-3-yl]-1,3-diphenylpyrazole?
The canonical SMILES for 4-[5-(4-fluorophenyl)-2-phenyl-3,4-dihydropyrazol-3-yl]-1,3-diphenylpyrazole is Fc1ccc(C2=NN(c3ccccc3)C(c3cn(-c4ccccc4)nc3-c3ccccc3)C2)cc1.
What is the InChIKey of 4-[5-(4-fluorophenyl)-2-phenyl-3,4-dihydropyrazol-3-yl]-1,3-diphenylpyrazole?
The InChIKey is JZDSFNNZPFBPBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H23FN4/c31-24-18-16-22(17-19-24)28-20-29(35(32-28)26-14-8-3-9-15-26)27-21-34(25-12-6-2-7-13-25)33-30(27)23-10-4-1-5-11-23/h1-19,21,29H,20H2.
What are the key properties of 4-[5-(4-fluorophenyl)-2-phenyl-3,4-dihydropyrazol-3-yl]-1,3-diphenylpyrazole?
4-[5-(4-fluorophenyl)-2-phenyl-3,4-dihydropyrazol-3-yl]-1,3-diphenylpyrazole has a molecular weight of 458.54 g/mol, XLogP of 7.03, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-(4-fluorophenyl)-2-phenyl-3,4-dihydropyrazol-3-yl]-1,3-diphenylpyrazole is sourced from PubChem (CID 15890048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).