1-(2,4-dichlorophenyl)-2-(4-fluorophenyl)-3-imidazol-1-ylpropan-2-ol

C18H15Cl2FN2O — CID 20519440

IUPAC1-(2,4-dichlorophenyl)-2-(4-fluorophenyl)-3-imidazol-1-ylpropan-2-ol
SMILESOC(Cc1ccc(Cl)cc1Cl)(Cn1ccnc1)c1ccc(F)cc1
InChIInChI=1S/C18H15Cl2FN2O/c19-15-4-1-13(17(20)9-15)10-18(24,11-23-8-7-22-12-23)14-2-5-16(21)6-3-14/h1-9,12,24H,10-11H2
InChIKeyTXNLAAGYGYNDEA-UHFFFAOYSA-N
MW365.24 g/mol
LogP4.46
Rot. Bonds5

About 1-(2,4-dichlorophenyl)-2-(4-fluorophenyl)-3-imidazol-1-ylpropan-2-ol

1-(2,4-dichlorophenyl)-2-(4-fluorophenyl)-3-imidazol-1-ylpropan-2-ol (PubChem CID 20519440) has the molecular formula C18H15Cl2FN2O and a molecular weight of 365.24 g/mol. Its IUPAC name is 1-(2,4-dichlorophenyl)-2-(4-fluorophenyl)-3-imidazol-1-ylpropan-2-ol.

Molecular Properties

Compound Name1-(2,4-dichlorophenyl)-2-(4-fluorophenyl)-3-imidazol-1-ylpropan-2-ol
PubChem CID20519440
Molecular FormulaC18H15Cl2FN2O
Molecular Weight365.24 g/mol
Exact Mass364.05
IUPAC Name1-(2,4-dichlorophenyl)-2-(4-fluorophenyl)-3-imidazol-1-ylpropan-2-ol
SMILESOC(Cc1ccc(Cl)cc1Cl)(Cn1ccnc1)c1ccc(F)cc1
InChIInChI=1S/C18H15Cl2FN2O/c19-15-4-1-13(17(20)9-15)10-18(24,11-23-8-7-22-12-23)14-2-5-16(21)6-3-14/h1-9,12,24H,10-11H2
InChIKeyTXNLAAGYGYNDEA-UHFFFAOYSA-N
XLogP4.46
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.24
LogP ≤ 54.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2,4-dichlorophenyl)-3-imidazol-1-yl-2-(4-iodophenyl)propan-2-ol;nitric acid
CID 70549876
2-(4-fluorophenyl)-1-imidazol-1-ylpent-4-en-2-ol
CID 12771346
1-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-2-imidazol-1-ylethanol
CID 20519458
2-(2,4-dichlorophenyl)-1-imidazol-1-yl-4-methylpentan-2-ol
CID 13058890
2-(2,4-dichlorophenyl)-1-imidazol-1-yl-3-piperazin-1-ylpropan-2-ol
CID 70480605
2-(2,4-dichlorophenyl)-1-imidazol-1-ylpent-4-en-2-ol;hydrochloride
CID 70569120
2-(4-chlorophenyl)-1-imidazol-1-yl-4-phenylbutan-2-ol
CID 14076108
1-(2,4-dichlorophenyl)-2-imidazol-1-yl-1-phenylethanol
CID 13269114
2-(2-bromo-4-chlorophenyl)-1-(2-chlorophenyl)-3-imidazol-1-ylpropan-2-ol;nitric acid
CID 70550084
(2R)-2-(2,4-difluorophenyl)-1-imidazol-1-ylbutan-2-ol
CID 67853018
2-(2,4-dichlorophenyl)-1-imidazol-1-yl-3-morpholin-4-ylpropan-2-ol
CID 13189528
2-(2,4-dichlorophenyl)-1-imidazol-1-yl-3-prop-2-enoxypropan-2-ol
CID 3068282

Frequently Asked Questions

What is the IUPAC name of 1-(2,4-dichlorophenyl)-2-(4-fluorophenyl)-3-imidazol-1-ylpropan-2-ol?
The IUPAC name of 1-(2,4-dichlorophenyl)-2-(4-fluorophenyl)-3-imidazol-1-ylpropan-2-ol (CID 20519440) is 1-(2,4-dichlorophenyl)-2-(4-fluorophenyl)-3-imidazol-1-ylpropan-2-ol.
What is the SMILES notation for 1-(2,4-dichlorophenyl)-2-(4-fluorophenyl)-3-imidazol-1-ylpropan-2-ol?
The canonical SMILES for 1-(2,4-dichlorophenyl)-2-(4-fluorophenyl)-3-imidazol-1-ylpropan-2-ol is OC(Cc1ccc(Cl)cc1Cl)(Cn1ccnc1)c1ccc(F)cc1.
What is the InChIKey of 1-(2,4-dichlorophenyl)-2-(4-fluorophenyl)-3-imidazol-1-ylpropan-2-ol?
The InChIKey is TXNLAAGYGYNDEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15Cl2FN2O/c19-15-4-1-13(17(20)9-15)10-18(24,11-23-8-7-22-12-23)14-2-5-16(21)6-3-14/h1-9,12,24H,10-11H2.
What are the key properties of 1-(2,4-dichlorophenyl)-2-(4-fluorophenyl)-3-imidazol-1-ylpropan-2-ol?
1-(2,4-dichlorophenyl)-2-(4-fluorophenyl)-3-imidazol-1-ylpropan-2-ol has a molecular weight of 365.24 g/mol, XLogP of 4.46, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-dichlorophenyl)-2-(4-fluorophenyl)-3-imidazol-1-ylpropan-2-ol is sourced from PubChem (CID 20519440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).