2-[2-(2-chloro-6-fluorophenyl)-1-(2-chlorophenyl)imidazol-4-yl]propan-2-ol

C18H15Cl2FN2O — CID 141164391

IUPAC2-[2-(2-chloro-6-fluorophenyl)-1-(2-chlorophenyl)imidazol-4-yl]propan-2-ol
SMILESCC(C)(O)c1cn(-c2ccccc2Cl)c(-c2c(F)cccc2Cl)n1
InChIInChI=1S/C18H15Cl2FN2O/c1-18(2,24)15-10-23(14-9-4-3-6-11(14)19)17(22-15)16-12(20)7-5-8-13(16)21/h3-10,24H,1-2H3
InChIKeyBJBMUZWGBWBGAP-UHFFFAOYSA-N
MW365.24 g/mol
LogP5.21
Rot. Bonds3

About 2-[2-(2-chloro-6-fluorophenyl)-1-(2-chlorophenyl)imidazol-4-yl]propan-2-ol

2-[2-(2-chloro-6-fluorophenyl)-1-(2-chlorophenyl)imidazol-4-yl]propan-2-ol (PubChem CID 141164391) has the molecular formula C18H15Cl2FN2O and a molecular weight of 365.24 g/mol. Its IUPAC name is 2-[2-(2-chloro-6-fluorophenyl)-1-(2-chlorophenyl)imidazol-4-yl]propan-2-ol.

Molecular Properties

Compound Name2-[2-(2-chloro-6-fluorophenyl)-1-(2-chlorophenyl)imidazol-4-yl]propan-2-ol
PubChem CID141164391
Molecular FormulaC18H15Cl2FN2O
Molecular Weight365.24 g/mol
Exact Mass364.05
IUPAC Name2-[2-(2-chloro-6-fluorophenyl)-1-(2-chlorophenyl)imidazol-4-yl]propan-2-ol
SMILESCC(C)(O)c1cn(-c2ccccc2Cl)c(-c2c(F)cccc2Cl)n1
InChIInChI=1S/C18H15Cl2FN2O/c1-18(2,24)15-10-23(14-9-4-3-6-11(14)19)17(22-15)16-12(20)7-5-8-13(16)21/h3-10,24H,1-2H3
InChIKeyBJBMUZWGBWBGAP-UHFFFAOYSA-N
XLogP5.21
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500365.24
LogP ≤ 55.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-(2-chloro-6-fluorophenyl)-1-[2-methyl-4-(3-methylsulfonylphenyl)phenyl]imidazol-4-yl]propan-2-ol
CID 59251471
2-[2-(2,6-dichlorophenyl)-1-[2-fluoro-4-(3-methylsulfonylphenyl)phenyl]imidazol-4-yl]propan-2-ol
CID 15948381
2-[2-(3-chloro-2-methylphenyl)-1-[2-fluoro-4-(3-methylphenyl)phenyl]imidazol-4-yl]propan-2-ol
CID 90377897
4-[3-chloro-4-[2-(2-chloro-6-fluorophenyl)-4-(2-hydroxypropan-2-yl)imidazol-1-yl]phenyl]-N-methoxy-N-methyl-2-methylsulfonylbenzamide;4-[3-chloro-4-[2-(2-chloro-6-fluorophenyl)-4-(2-hydroxypropan-2-yl)imidazol-1-yl]phenyl]-2-methylsulfonylbenzoic acid;ethyl 4-[3-chloro-4-[2-(2-chloro-6-fluorophenyl)-4-(2-hydroxypropan-2-yl)imidazol-1-yl]phenyl]-2-methylsulfonylbenzoate
CID 160668357
2-[1-[2-chloro-3-(3-chlorophenyl)phenyl]-2-[2-(trifluoromethyl)phenyl]imidazol-4-yl]propan-2-ol
CID 154280412
2-[4-[4-[2-(2,3-dichlorophenyl)-4-(2-hydroxypropan-2-yl)imidazol-1-yl]phenyl]phenyl]propan-2-ol
CID 59251333
2-[2-(2,6-difluorophenyl)-1-[4-[4-(hydroxymethyl)-3-methylsulfonylphenyl]phenyl]imidazol-4-yl]propan-2-ol
CID 59251663
2-[1-[2-chloro-4-[4-(hydroxymethyl)-3-methylsulfonylphenyl]phenyl]-2-(2-chlorophenyl)imidazol-4-yl]propan-2-ol
CID 59251429
2-(2-chloro-6-fluorophenyl)-1-methylimidazole
CID 82077992
2-[1-(4-bromophenyl)-2-(2,6-difluorophenyl)imidazol-4-yl]propan-2-ol;2-[2-(2,6-difluorophenyl)-1-[4-(3-methylsulfonylphenyl)phenyl]imidazol-4-yl]propan-2-ol;methane
CID 158433126
2-[1-(2,6-dichlorophenyl)-2-[4-(3-ethylsulfonylphenyl)phenyl]imidazol-4-yl]propan-2-ol
CID 59251279
2-[4-[4-[2-(2,3-dichlorophenyl)-4-(2-hydroxypropan-2-yl)imidazol-1-yl]phenyl]-2-methylsulfonylphenyl]propan-2-ol
CID 59251660

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-chloro-6-fluorophenyl)-1-(2-chlorophenyl)imidazol-4-yl]propan-2-ol?
The IUPAC name of 2-[2-(2-chloro-6-fluorophenyl)-1-(2-chlorophenyl)imidazol-4-yl]propan-2-ol (CID 141164391) is 2-[2-(2-chloro-6-fluorophenyl)-1-(2-chlorophenyl)imidazol-4-yl]propan-2-ol.
What is the SMILES notation for 2-[2-(2-chloro-6-fluorophenyl)-1-(2-chlorophenyl)imidazol-4-yl]propan-2-ol?
The canonical SMILES for 2-[2-(2-chloro-6-fluorophenyl)-1-(2-chlorophenyl)imidazol-4-yl]propan-2-ol is CC(C)(O)c1cn(-c2ccccc2Cl)c(-c2c(F)cccc2Cl)n1.
What is the InChIKey of 2-[2-(2-chloro-6-fluorophenyl)-1-(2-chlorophenyl)imidazol-4-yl]propan-2-ol?
The InChIKey is BJBMUZWGBWBGAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15Cl2FN2O/c1-18(2,24)15-10-23(14-9-4-3-6-11(14)19)17(22-15)16-12(20)7-5-8-13(16)21/h3-10,24H,1-2H3.
What are the key properties of 2-[2-(2-chloro-6-fluorophenyl)-1-(2-chlorophenyl)imidazol-4-yl]propan-2-ol?
2-[2-(2-chloro-6-fluorophenyl)-1-(2-chlorophenyl)imidazol-4-yl]propan-2-ol has a molecular weight of 365.24 g/mol, XLogP of 5.21, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-chloro-6-fluorophenyl)-1-(2-chlorophenyl)imidazol-4-yl]propan-2-ol is sourced from PubChem (CID 141164391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).