5-(4-fluorophenoxy)-2-pyrazol-1-yl-6-(trifluoromethyl)-1H-benzimidazole

C17H10F4N4O — CID 141443536

IUPAC5-(4-fluorophenoxy)-2-pyrazol-1-yl-6-(trifluoromethyl)-1H-benzimidazole
SMILESFc1ccc(Oc2cc3nc(-n4cccn4)[nH]c3cc2C(F)(F)F)cc1
InChIInChI=1S/C17H10F4N4O/c18-10-2-4-11(5-3-10)26-15-9-14-13(8-12(15)17(19,20)21)23-16(24-14)25-7-1-6-22-25/h1-9H,(H,23,24)
InChIKeyIHIODRZZSSRDPR-UHFFFAOYSA-N
MW362.29 g/mol
LogP4.70
Rot. Bonds3

About 5-(4-fluorophenoxy)-2-pyrazol-1-yl-6-(trifluoromethyl)-1H-benzimidazole

5-(4-fluorophenoxy)-2-pyrazol-1-yl-6-(trifluoromethyl)-1H-benzimidazole (PubChem CID 141443536) has the molecular formula C17H10F4N4O and a molecular weight of 362.29 g/mol. Its IUPAC name is 5-(4-fluorophenoxy)-2-pyrazol-1-yl-6-(trifluoromethyl)-1H-benzimidazole.

Molecular Properties

Compound Name5-(4-fluorophenoxy)-2-pyrazol-1-yl-6-(trifluoromethyl)-1H-benzimidazole
PubChem CID141443536
Molecular FormulaC17H10F4N4O
Molecular Weight362.29 g/mol
Exact Mass362.08
IUPAC Name5-(4-fluorophenoxy)-2-pyrazol-1-yl-6-(trifluoromethyl)-1H-benzimidazole
SMILESFc1ccc(Oc2cc3nc(-n4cccn4)[nH]c3cc2C(F)(F)F)cc1
InChIInChI=1S/C17H10F4N4O/c18-10-2-4-11(5-3-10)26-15-9-14-13(8-12(15)17(19,20)21)23-16(24-14)25-7-1-6-22-25/h1-9H,(H,23,24)
InChIKeyIHIODRZZSSRDPR-UHFFFAOYSA-N
XLogP4.70
TPSA55.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.29
LogP ≤ 54.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-(4-fluorophenoxy)-2-pyrazol-1-yl-6-(trifluoromethyl)-1H-benzimidazole 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

5,6-dimethoxy-2-pyrazol-1-yl-1H-benzimidazole
CID 66937003
6-fluoro-5-methylsulfanyl-2-pyrazol-1-yl-1H-benzimidazole
CID 141252349
2-pyrazol-1-yl-6-[3-(trifluoromethyl)phenyl]-1H-benzimidazole
CID 141252366
6-propan-2-ylsulfonyl-2-pyrazol-1-yl-5-(trifluoromethoxy)-1H-benzimidazole
CID 141443546
1-[4-(4-fluorophenoxy)phenyl]pyrazole
CID 22025364
2-pyrazol-1-yl-1H-benzimidazole
CID 639420
6-chloro-5-[4-chloro-3-(trifluoromethyl)phenoxy]-2-(trifluoromethyl)-1H-benzimidazole
CID 154140309
7-phenoxy-2-pyrazol-1-yl-3H-quinazolin-4-one
CID 136641811
5-(3,4-dichlorophenoxy)-6-(trifluoromethyl)-1H-benzimidazole
CID 141252314
5-(4-bromophenoxy)-6-chloro-2-(trifluoromethyl)-1H-benzimidazole
CID 154116934
6-chloro-5-piperidin-1-yl-2-pyrazol-1-yl-1H-benzimidazole
CID 141252332
N,N-dimethyl-2-(4-pyrazol-1-ylphenoxy)-6-(trifluoromethyl)pyrimidin-4-amine
CID 138038755

Frequently Asked Questions

What is the IUPAC name of 5-(4-fluorophenoxy)-2-pyrazol-1-yl-6-(trifluoromethyl)-1H-benzimidazole?
The IUPAC name of 5-(4-fluorophenoxy)-2-pyrazol-1-yl-6-(trifluoromethyl)-1H-benzimidazole (CID 141443536) is 5-(4-fluorophenoxy)-2-pyrazol-1-yl-6-(trifluoromethyl)-1H-benzimidazole.
What is the SMILES notation for 5-(4-fluorophenoxy)-2-pyrazol-1-yl-6-(trifluoromethyl)-1H-benzimidazole?
The canonical SMILES for 5-(4-fluorophenoxy)-2-pyrazol-1-yl-6-(trifluoromethyl)-1H-benzimidazole is Fc1ccc(Oc2cc3nc(-n4cccn4)[nH]c3cc2C(F)(F)F)cc1.
What is the InChIKey of 5-(4-fluorophenoxy)-2-pyrazol-1-yl-6-(trifluoromethyl)-1H-benzimidazole?
The InChIKey is IHIODRZZSSRDPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H10F4N4O/c18-10-2-4-11(5-3-10)26-15-9-14-13(8-12(15)17(19,20)21)23-16(24-14)25-7-1-6-22-25/h1-9H,(H,23,24).
What are the key properties of 5-(4-fluorophenoxy)-2-pyrazol-1-yl-6-(trifluoromethyl)-1H-benzimidazole?
5-(4-fluorophenoxy)-2-pyrazol-1-yl-6-(trifluoromethyl)-1H-benzimidazole has a molecular weight of 362.29 g/mol, XLogP of 4.70, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-fluorophenoxy)-2-pyrazol-1-yl-6-(trifluoromethyl)-1H-benzimidazole is sourced from PubChem (CID 141443536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).