[2-methyl-4-(4-methylphenyl)phenyl]-[3-[(3-methylphenyl)methyl]imidazol-4-yl]methanol

C26H26N2O — CID 54432683

IUPAC[2-methyl-4-(4-methylphenyl)phenyl]-[3-[(3-methylphenyl)methyl]imidazol-4-yl]methanol
SMILESCc1ccc(-c2ccc(C(O)c3cncn3Cc3cccc(C)c3)c(C)c2)cc1
InChIInChI=1S/C26H26N2O/c1-18-7-9-22(10-8-18)23-11-12-24(20(3)14-23)26(29)25-15-27-17-28(25)16-21-6-4-5-19(2)13-21/h4-15,17,26,29H,16H2,1-3H3
InChIKeyWIPKESVTDVKRFE-UHFFFAOYSA-N
MW382.51 g/mol
LogP5.61
Rot. Bonds5

About [2-methyl-4-(4-methylphenyl)phenyl]-[3-[(3-methylphenyl)methyl]imidazol-4-yl]methanol

[2-methyl-4-(4-methylphenyl)phenyl]-[3-[(3-methylphenyl)methyl]imidazol-4-yl]methanol (PubChem CID 54432683) has the molecular formula C26H26N2O and a molecular weight of 382.51 g/mol. Its IUPAC name is [2-methyl-4-(4-methylphenyl)phenyl]-[3-[(3-methylphenyl)methyl]imidazol-4-yl]methanol.

Molecular Properties

Compound Name[2-methyl-4-(4-methylphenyl)phenyl]-[3-[(3-methylphenyl)methyl]imidazol-4-yl]methanol
PubChem CID54432683
Molecular FormulaC26H26N2O
Molecular Weight382.51 g/mol
Exact Mass382.20
IUPAC Name[2-methyl-4-(4-methylphenyl)phenyl]-[3-[(3-methylphenyl)methyl]imidazol-4-yl]methanol
SMILESCc1ccc(-c2ccc(C(O)c3cncn3Cc3cccc(C)c3)c(C)c2)cc1
InChIInChI=1S/C26H26N2O/c1-18-7-9-22(10-8-18)23-11-12-24(20(3)14-23)26(29)25-15-27-17-28(25)16-21-6-4-5-19(2)13-21/h4-15,17,26,29H,16H2,1-3H3
InChIKeyWIPKESVTDVKRFE-UHFFFAOYSA-N
XLogP5.61
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms29
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500382.51
LogP ≤ 55.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [2-methyl-4-(4-methylphenyl)phenyl]-[3-[(3-methylphenyl)methyl]imidazol-4-yl]methanol?
The IUPAC name of [2-methyl-4-(4-methylphenyl)phenyl]-[3-[(3-methylphenyl)methyl]imidazol-4-yl]methanol (CID 54432683) is [2-methyl-4-(4-methylphenyl)phenyl]-[3-[(3-methylphenyl)methyl]imidazol-4-yl]methanol.
What is the SMILES notation for [2-methyl-4-(4-methylphenyl)phenyl]-[3-[(3-methylphenyl)methyl]imidazol-4-yl]methanol?
The canonical SMILES for [2-methyl-4-(4-methylphenyl)phenyl]-[3-[(3-methylphenyl)methyl]imidazol-4-yl]methanol is Cc1ccc(-c2ccc(C(O)c3cncn3Cc3cccc(C)c3)c(C)c2)cc1.
What is the InChIKey of [2-methyl-4-(4-methylphenyl)phenyl]-[3-[(3-methylphenyl)methyl]imidazol-4-yl]methanol?
The InChIKey is WIPKESVTDVKRFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H26N2O/c1-18-7-9-22(10-8-18)23-11-12-24(20(3)14-23)26(29)25-15-27-17-28(25)16-21-6-4-5-19(2)13-21/h4-15,17,26,29H,16H2,1-3H3.
What are the key properties of [2-methyl-4-(4-methylphenyl)phenyl]-[3-[(3-methylphenyl)methyl]imidazol-4-yl]methanol?
[2-methyl-4-(4-methylphenyl)phenyl]-[3-[(3-methylphenyl)methyl]imidazol-4-yl]methanol has a molecular weight of 382.51 g/mol, XLogP of 5.61, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-methyl-4-(4-methylphenyl)phenyl]-[3-[(3-methylphenyl)methyl]imidazol-4-yl]methanol is sourced from PubChem (CID 54432683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).