[5-chloro-3-(2,6-difluorophenyl)imidazol-4-yl]-(2-chloro-4-fluorophenyl)methanol

C16H9Cl2F3N2O — CID 66835568

IUPAC[5-chloro-3-(2,6-difluorophenyl)imidazol-4-yl]-(2-chloro-4-fluorophenyl)methanol
SMILESOC(c1ccc(F)cc1Cl)c1c(Cl)ncn1-c1c(F)cccc1F
InChIInChI=1S/C16H9Cl2F3N2O/c17-10-6-8(19)4-5-9(10)15(24)14-16(18)22-7-23(14)13-11(20)2-1-3-12(13)21/h1-7,15,24H
InChIKeyJIMKTQYKDFMHPW-UHFFFAOYSA-N
MW373.16 g/mol
LogP4.68
Rot. Bonds3

About [5-chloro-3-(2,6-difluorophenyl)imidazol-4-yl]-(2-chloro-4-fluorophenyl)methanol

[5-chloro-3-(2,6-difluorophenyl)imidazol-4-yl]-(2-chloro-4-fluorophenyl)methanol (PubChem CID 66835568) has the molecular formula C16H9Cl2F3N2O and a molecular weight of 373.16 g/mol. Its IUPAC name is [5-chloro-3-(2,6-difluorophenyl)imidazol-4-yl]-(2-chloro-4-fluorophenyl)methanol.

Molecular Properties

Compound Name[5-chloro-3-(2,6-difluorophenyl)imidazol-4-yl]-(2-chloro-4-fluorophenyl)methanol
PubChem CID66835568
Molecular FormulaC16H9Cl2F3N2O
Molecular Weight373.16 g/mol
Exact Mass372.00
IUPAC Name[5-chloro-3-(2,6-difluorophenyl)imidazol-4-yl]-(2-chloro-4-fluorophenyl)methanol
SMILESOC(c1ccc(F)cc1Cl)c1c(Cl)ncn1-c1c(F)cccc1F
InChIInChI=1S/C16H9Cl2F3N2O/c17-10-6-8(19)4-5-9(10)15(24)14-16(18)22-7-23(14)13-11(20)2-1-3-12(13)21/h1-7,15,24H
InChIKeyJIMKTQYKDFMHPW-UHFFFAOYSA-N
XLogP4.68
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.16
LogP ≤ 54.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2-chloro-4-fluorophenyl)-(7-fluoro-1-benzofuran-2-yl)methanol
CID 114726486
(2-chloro-4-fluorophenyl)-[5-(2,6-difluorophenyl)-1,3-dimethylpyrazol-4-yl]methanol
CID 141429995
[4-chloro-2-(2,6-difluorophenyl)-1H-imidazol-5-yl]-(2-chloro-4-fluorophenyl)methanol
CID 123676797
[2-chloro-3-(2-chloro-6-fluorophenyl)-5-methylimidazol-4-yl]-(2,4-difluorophenyl)methanol
CID 66834827
(2-chloro-4-fluorophenyl)-(2,4,6-trifluorophenyl)methanol
CID 61089185
(4-bromo-1-propan-2-ylpyrazol-5-yl)-(2-chloro-4-fluorophenyl)methanol
CID 114643499
[2-chloro-3-(2-chloro-4-fluorophenyl)-5-methylimidazol-4-yl]-(2-chloro-4-fluorophenyl)methanol
CID 66835439
(2-chloro-4-fluorophenyl)-pyridin-3-ylmethanol
CID 62945841
[5-bromo-2-chloro-3-(2,6-difluorophenyl)imidazol-4-yl]-(2-chloro-4-methoxyphenyl)methanol
CID 66835323
(2-chloro-4-fluorophenyl)-(2-phenylpyrazol-3-yl)methanol
CID 107330323
(2-chloro-4-fluorophenyl)-(2-fluoro-3-methoxyphenyl)methanol
CID 82807676
(2-chloro-4-fluorophenyl)-quinolin-6-ylmethanol
CID 81220584

Frequently Asked Questions

What is the IUPAC name of [5-chloro-3-(2,6-difluorophenyl)imidazol-4-yl]-(2-chloro-4-fluorophenyl)methanol?
The IUPAC name of [5-chloro-3-(2,6-difluorophenyl)imidazol-4-yl]-(2-chloro-4-fluorophenyl)methanol (CID 66835568) is [5-chloro-3-(2,6-difluorophenyl)imidazol-4-yl]-(2-chloro-4-fluorophenyl)methanol.
What is the SMILES notation for [5-chloro-3-(2,6-difluorophenyl)imidazol-4-yl]-(2-chloro-4-fluorophenyl)methanol?
The canonical SMILES for [5-chloro-3-(2,6-difluorophenyl)imidazol-4-yl]-(2-chloro-4-fluorophenyl)methanol is OC(c1ccc(F)cc1Cl)c1c(Cl)ncn1-c1c(F)cccc1F.
What is the InChIKey of [5-chloro-3-(2,6-difluorophenyl)imidazol-4-yl]-(2-chloro-4-fluorophenyl)methanol?
The InChIKey is JIMKTQYKDFMHPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H9Cl2F3N2O/c17-10-6-8(19)4-5-9(10)15(24)14-16(18)22-7-23(14)13-11(20)2-1-3-12(13)21/h1-7,15,24H.
What are the key properties of [5-chloro-3-(2,6-difluorophenyl)imidazol-4-yl]-(2-chloro-4-fluorophenyl)methanol?
[5-chloro-3-(2,6-difluorophenyl)imidazol-4-yl]-(2-chloro-4-fluorophenyl)methanol has a molecular weight of 373.16 g/mol, XLogP of 4.68, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [5-chloro-3-(2,6-difluorophenyl)imidazol-4-yl]-(2-chloro-4-fluorophenyl)methanol is sourced from PubChem (CID 66835568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).