4-chloro-2-[(2-chloro-6-fluorophenyl)methyl]-1H-benzimidazole

C14H9Cl2FN2 — CID 64724734

IUPAC4-chloro-2-[(2-chloro-6-fluorophenyl)methyl]-1H-benzimidazole
SMILESFc1cccc(Cl)c1Cc1nc2c(Cl)cccc2[nH]1
InChIInChI=1S/C14H9Cl2FN2/c15-9-3-1-5-11(17)8(9)7-13-18-12-6-2-4-10(16)14(12)19-13/h1-6H,7H2,(H,18,19)
InChIKeyXVNAWZCFTUAUFD-UHFFFAOYSA-N
MW295.14 g/mol
LogP4.60
Rot. Bonds2

About 4-chloro-2-[(2-chloro-6-fluorophenyl)methyl]-1H-benzimidazole

4-chloro-2-[(2-chloro-6-fluorophenyl)methyl]-1H-benzimidazole (PubChem CID 64724734) has the molecular formula C14H9Cl2FN2 and a molecular weight of 295.14 g/mol. Its IUPAC name is 4-chloro-2-[(2-chloro-6-fluorophenyl)methyl]-1H-benzimidazole.

Molecular Properties

Compound Name4-chloro-2-[(2-chloro-6-fluorophenyl)methyl]-1H-benzimidazole
PubChem CID64724734
Molecular FormulaC14H9Cl2FN2
Molecular Weight295.14 g/mol
Exact Mass294.01
IUPAC Name4-chloro-2-[(2-chloro-6-fluorophenyl)methyl]-1H-benzimidazole
SMILESFc1cccc(Cl)c1Cc1nc2c(Cl)cccc2[nH]1
InChIInChI=1S/C14H9Cl2FN2/c15-9-3-1-5-11(17)8(9)7-13-18-12-6-2-4-10(16)14(12)19-13/h1-6H,7H2,(H,18,19)
InChIKeyXVNAWZCFTUAUFD-UHFFFAOYSA-N
XLogP4.60
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.14
LogP ≤ 54.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 4-chloro-2-[(2-chloro-6-fluorophenyl)methyl]-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

4-chloro-2-[(4-fluorophenyl)methyl]-1H-benzimidazole
CID 60978001
4-chloro-2-(pyridin-4-ylmethyl)-1H-benzimidazole
CID 60978006
2-[(2-chloro-6-fluorophenyl)methyl]-6-methyl-1H-imidazo[4,5-b]pyridine
CID 79795368
4-chloro-2-(2,2,2-trifluoroethyl)-1H-benzimidazole
CID 60978005
2-[(4-bromophenyl)methyl]-4-chloro-1H-benzimidazole
CID 64722299
2,5-bis[(2,6-difluorophenyl)methyl]-4-methyl-1H-benzimidazole
CID 70100769
4-chloro-2-[(3-iodophenyl)methyl]-1H-benzimidazole
CID 141189782
5-bromo-2-[(2-chloro-6-fluorophenyl)methyl]-4-hydroxy-1H-pyrimidin-6-one
CID 66284565
2-[(2-chloro-6-fluorophenyl)methyl]-5-methyl-1H-imidazole-4-carboxylic acid
CID 82305221
5-[5-[(2-chloro-6-fluorophenyl)methyl]-1H-1,2,4-triazol-3-yl]pentan-1-amine
CID 82568554
4-chloro-2-[(2-methoxyphenyl)methyl]-1H-benzimidazole
CID 60979217
2-[(2-chloro-6-fluorophenyl)methyl]-5,6,7,8-tetrahydro-1H-quinazoline-4-thione
CID 106477261

Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-[(2-chloro-6-fluorophenyl)methyl]-1H-benzimidazole?
The IUPAC name of 4-chloro-2-[(2-chloro-6-fluorophenyl)methyl]-1H-benzimidazole (CID 64724734) is 4-chloro-2-[(2-chloro-6-fluorophenyl)methyl]-1H-benzimidazole.
What is the SMILES notation for 4-chloro-2-[(2-chloro-6-fluorophenyl)methyl]-1H-benzimidazole?
The canonical SMILES for 4-chloro-2-[(2-chloro-6-fluorophenyl)methyl]-1H-benzimidazole is Fc1cccc(Cl)c1Cc1nc2c(Cl)cccc2[nH]1.
What is the InChIKey of 4-chloro-2-[(2-chloro-6-fluorophenyl)methyl]-1H-benzimidazole?
The InChIKey is XVNAWZCFTUAUFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9Cl2FN2/c15-9-3-1-5-11(17)8(9)7-13-18-12-6-2-4-10(16)14(12)19-13/h1-6H,7H2,(H,18,19).
What are the key properties of 4-chloro-2-[(2-chloro-6-fluorophenyl)methyl]-1H-benzimidazole?
4-chloro-2-[(2-chloro-6-fluorophenyl)methyl]-1H-benzimidazole has a molecular weight of 295.14 g/mol, XLogP of 4.60, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-[(2-chloro-6-fluorophenyl)methyl]-1H-benzimidazole is sourced from PubChem (CID 64724734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).