4-(4-bromophenyl)-2-[3-(4-fluorophenyl)-1-phenylpyrazol-4-yl]-1,3-thiazole

C24H15BrFN3S — CID 71732867

IUPAC4-(4-bromophenyl)-2-[3-(4-fluorophenyl)-1-phenylpyrazol-4-yl]-1,3-thiazole
SMILESFc1ccc(-c2nn(-c3ccccc3)cc2-c2nc(-c3ccc(Br)cc3)cs2)cc1
InChIInChI=1S/C24H15BrFN3S/c25-18-10-6-16(7-11-18)22-15-30-24(27-22)21-14-29(20-4-2-1-3-5-20)28-23(21)17-8-12-19(26)13-9-17/h1-15H
InChIKeyILBVSZSNEQWDEA-UHFFFAOYSA-N
MW476.37 g/mol
LogP7.23
Rot. Bonds4

About 4-(4-bromophenyl)-2-[3-(4-fluorophenyl)-1-phenylpyrazol-4-yl]-1,3-thiazole

4-(4-bromophenyl)-2-[3-(4-fluorophenyl)-1-phenylpyrazol-4-yl]-1,3-thiazole (PubChem CID 71732867) has the molecular formula C24H15BrFN3S and a molecular weight of 476.37 g/mol. Its IUPAC name is 4-(4-bromophenyl)-2-[3-(4-fluorophenyl)-1-phenylpyrazol-4-yl]-1,3-thiazole.

Molecular Properties

Compound Name4-(4-bromophenyl)-2-[3-(4-fluorophenyl)-1-phenylpyrazol-4-yl]-1,3-thiazole
PubChem CID71732867
Molecular FormulaC24H15BrFN3S
Molecular Weight476.37 g/mol
Exact Mass475.02
IUPAC Name4-(4-bromophenyl)-2-[3-(4-fluorophenyl)-1-phenylpyrazol-4-yl]-1,3-thiazole
SMILESFc1ccc(-c2nn(-c3ccccc3)cc2-c2nc(-c3ccc(Br)cc3)cs2)cc1
InChIInChI=1S/C24H15BrFN3S/c25-18-10-6-16(7-11-18)22-15-30-24(27-22)21-14-29(20-4-2-1-3-5-20)28-23(21)17-8-12-19(26)13-9-17/h1-15H
InChIKeyILBVSZSNEQWDEA-UHFFFAOYSA-N
XLogP7.23
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500476.37
LogP ≤ 57.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 4-(4-bromophenyl)-2-[3-(4-fluorophenyl)-1-phenylpyrazol-4-yl]-1,3-thiazole 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-[3-(4-bromophenyl)-1-phenylpyrazol-4-yl]-4-(4-methylphenyl)-1,3-thiazole
CID 71732963
3-(4-fluorophenyl)-1-phenylpyrazol-4-amine
CID 2104091
3-(4-bromophenyl)-1-phenylpyrazol-4-ol
CID 99938057
2-[2-(1,3-diphenylpyrazol-4-yl)ethenyl]-4-phenyl-1,3-thiazole
CID 3250858
6-[3-(4-fluorophenyl)-1-phenylpyrazol-4-yl]-4-(4-methylphenyl)-1H-pyrimidine-2-thione
CID 57394189
ethyl 2-[3-(4-fluorophenyl)-1-phenylpyrazol-4-yl]-4-(4-methoxyphenyl)-1,3-thiazole-5-carboxylate
CID 118727560
2-(1,3-diphenylpyrazol-4-yl)-1,3-benzothiazole
CID 46870644
1,3,4-triphenylpyrazole
CID 555882
1-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-3-phenylpyrazole-4-carbaldehyde
CID 71732594
2-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-3-[3-(4-chlorophenyl)-1-phenylpyrazol-4-yl]prop-2-enenitrile
CID 4710356
2-(2-bromo-5-fluorophenyl)-4-phenyl-1,3-thiazole
CID 107924775
2-(1,3-diphenylpyrazol-4-yl)-4-phenyl-1,3-thiazole-5-carboxylic acid
CID 118727567

Frequently Asked Questions

What is the IUPAC name of 4-(4-bromophenyl)-2-[3-(4-fluorophenyl)-1-phenylpyrazol-4-yl]-1,3-thiazole?
The IUPAC name of 4-(4-bromophenyl)-2-[3-(4-fluorophenyl)-1-phenylpyrazol-4-yl]-1,3-thiazole (CID 71732867) is 4-(4-bromophenyl)-2-[3-(4-fluorophenyl)-1-phenylpyrazol-4-yl]-1,3-thiazole.
What is the SMILES notation for 4-(4-bromophenyl)-2-[3-(4-fluorophenyl)-1-phenylpyrazol-4-yl]-1,3-thiazole?
The canonical SMILES for 4-(4-bromophenyl)-2-[3-(4-fluorophenyl)-1-phenylpyrazol-4-yl]-1,3-thiazole is Fc1ccc(-c2nn(-c3ccccc3)cc2-c2nc(-c3ccc(Br)cc3)cs2)cc1.
What is the InChIKey of 4-(4-bromophenyl)-2-[3-(4-fluorophenyl)-1-phenylpyrazol-4-yl]-1,3-thiazole?
The InChIKey is ILBVSZSNEQWDEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H15BrFN3S/c25-18-10-6-16(7-11-18)22-15-30-24(27-22)21-14-29(20-4-2-1-3-5-20)28-23(21)17-8-12-19(26)13-9-17/h1-15H.
What are the key properties of 4-(4-bromophenyl)-2-[3-(4-fluorophenyl)-1-phenylpyrazol-4-yl]-1,3-thiazole?
4-(4-bromophenyl)-2-[3-(4-fluorophenyl)-1-phenylpyrazol-4-yl]-1,3-thiazole has a molecular weight of 476.37 g/mol, XLogP of 7.23, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-bromophenyl)-2-[3-(4-fluorophenyl)-1-phenylpyrazol-4-yl]-1,3-thiazole is sourced from PubChem (CID 71732867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).