1-[3-(4-chlorophenyl)-1-(3-fluorophenyl)pyrazol-5-yl]-4-phenylpiperazine

C25H22ClFN4 — CID 57332355

IUPAC1-[3-(4-chlorophenyl)-1-(3-fluorophenyl)pyrazol-5-yl]-4-phenylpiperazine
SMILESFc1cccc(-n2nc(-c3ccc(Cl)cc3)cc2N2CCN(c3ccccc3)CC2)c1
InChIInChI=1S/C25H22ClFN4/c26-20-11-9-19(10-12-20)24-18-25(31(28-24)23-8-4-5-21(27)17-23)30-15-13-29(14-16-30)22-6-2-1-3-7-22/h1-12,17-18H,13-16H2
InChIKeyUHXWIORJGIZKQR-UHFFFAOYSA-N
MW432.93 g/mol
LogP5.66
Rot. Bonds4

About 1-[3-(4-chlorophenyl)-1-(3-fluorophenyl)pyrazol-5-yl]-4-phenylpiperazine

1-[3-(4-chlorophenyl)-1-(3-fluorophenyl)pyrazol-5-yl]-4-phenylpiperazine (PubChem CID 57332355) has the molecular formula C25H22ClFN4 and a molecular weight of 432.93 g/mol. Its IUPAC name is 1-[3-(4-chlorophenyl)-1-(3-fluorophenyl)pyrazol-5-yl]-4-phenylpiperazine.

Molecular Properties

Compound Name1-[3-(4-chlorophenyl)-1-(3-fluorophenyl)pyrazol-5-yl]-4-phenylpiperazine
PubChem CID57332355
Molecular FormulaC25H22ClFN4
Molecular Weight432.93 g/mol
Exact Mass432.15
IUPAC Name1-[3-(4-chlorophenyl)-1-(3-fluorophenyl)pyrazol-5-yl]-4-phenylpiperazine
SMILESFc1cccc(-n2nc(-c3ccc(Cl)cc3)cc2N2CCN(c3ccccc3)CC2)c1
InChIInChI=1S/C25H22ClFN4/c26-20-11-9-19(10-12-20)24-18-25(31(28-24)23-8-4-5-21(27)17-23)30-15-13-29(14-16-30)22-6-2-1-3-7-22/h1-12,17-18H,13-16H2
InChIKeyUHXWIORJGIZKQR-UHFFFAOYSA-N
XLogP5.66
TPSA24.30 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500432.93
LogP ≤ 55.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1-[3-(4-chlorophenyl)-1-(3-fluorophenyl)pyrazol-5-yl]-4-phenylpiperazine with MolForge

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

Launch Full Analysis

Related Compounds

2-(4-Chlorophenyl)-5-methyl-7-(4-methylpiperazin-1-yl)-[1,2,4]triazolo[1,5-a]pyrimidine
CID 318119
N2-[5-(3-chlorophenyl)-2-phenyl-3-pyrazolyl]benzene-1,2-diamine
CID 2452268
1-[6-(2,4-dichlorobenzyl)-3-pyridazinyl]-4-(4-fluorophenyl)-1H-pyrazol-5-amine
CID 2766455
4-(4-Chlorophenyl)-3-methyl-1,5-diphenyl-4,7-dihydropyrazolo[5,4-d]pyrimidin-6-one
CID 3956519
4-[3-(4-Chlorophenyl)-2,5-dimethylpyrazolo[1,5-A]pyrimidin-7-YL]-2-methyl-1-(4-methylphenyl)piperazine
CID 4144184
2-N-[1-(3-chlorophenyl)-3-phenylpyrazol-5-yl]benzene-1,2-diamine
CID 4273494
7-(4-Benzyl-piperazin-1-yl)-3-[4-(4-chloro-phenyl)-piperazin-1-ylmethyl]-2-methyl-pyrazolo[1,5-a]pyridine
CID 44371980
3-(4-Chlorophenyl)-1-(4-fluorophenyl)-1H-pyrazol-5-amine
CID 2742645
1-(5-Chloro-2-methylphenyl)-4-{5-methyl-2-phenyl-[1,2,4]triazolo[1,5-A]pyrimidin-7-YL}piperazine
CID 15990237
1-[2-(4-Chlorophenyl)-5-methyl-[1,2,4]triazolo[1,5-A]pyrimidin-7-YL]-4-(4-fluorophenyl)piperazine
CID 16014531
3-[(4-Benzylpiperazin-1-yl)methyl]-1-(4-chlorophenyl)-4-phenylpyrazol-5-amine
CID 2420381
N2-[5-(4-chlorophenyl)-2-phenyl-3-pyrazolyl]benzene-1,2-diamine
CID 2423951

Frequently Asked Questions

What is the IUPAC name of 1-[3-(4-chlorophenyl)-1-(3-fluorophenyl)pyrazol-5-yl]-4-phenylpiperazine?
The IUPAC name of 1-[3-(4-chlorophenyl)-1-(3-fluorophenyl)pyrazol-5-yl]-4-phenylpiperazine (CID 57332355) is 1-[3-(4-chlorophenyl)-1-(3-fluorophenyl)pyrazol-5-yl]-4-phenylpiperazine.
What is the SMILES notation for 1-[3-(4-chlorophenyl)-1-(3-fluorophenyl)pyrazol-5-yl]-4-phenylpiperazine?
The canonical SMILES for 1-[3-(4-chlorophenyl)-1-(3-fluorophenyl)pyrazol-5-yl]-4-phenylpiperazine is Fc1cccc(-n2nc(-c3ccc(Cl)cc3)cc2N2CCN(c3ccccc3)CC2)c1.
What is the InChIKey of 1-[3-(4-chlorophenyl)-1-(3-fluorophenyl)pyrazol-5-yl]-4-phenylpiperazine?
The InChIKey is UHXWIORJGIZKQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H22ClFN4/c26-20-11-9-19(10-12-20)24-18-25(31(28-24)23-8-4-5-21(27)17-23)30-15-13-29(14-16-30)22-6-2-1-3-7-22/h1-12,17-18H,13-16H2.
What are the key properties of 1-[3-(4-chlorophenyl)-1-(3-fluorophenyl)pyrazol-5-yl]-4-phenylpiperazine?
1-[3-(4-chlorophenyl)-1-(3-fluorophenyl)pyrazol-5-yl]-4-phenylpiperazine has a molecular weight of 432.93 g/mol, XLogP of 5.66, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(4-chlorophenyl)-1-(3-fluorophenyl)pyrazol-5-yl]-4-phenylpiperazine is sourced from PubChem (CID 57332355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).