4-[4,5-bis[4-(dimethylamino)phenyl]-1-(2-phenylethyl)imidazol-2-yl]phenol

C33H34N4O — CID 135734282

IUPAC4-[4,5-bis[4-(dimethylamino)phenyl]-1-(2-phenylethyl)imidazol-2-yl]phenol
SMILESCN(C)c1ccc(-c2nc(-c3ccc(O)cc3)n(CCc3ccccc3)c2-c2ccc(N(C)C)cc2)cc1
InChIInChI=1S/C33H34N4O/c1-35(2)28-16-10-25(11-17-28)31-32(26-12-18-29(19-13-26)36(3)4)37(23-22-24-8-6-5-7-9-24)33(34-31)27-14-20-30(38)21-15-27/h5-21,38H,22-23H2,1-4H3
InChIKeyQPHYPPILGXVHSR-UHFFFAOYSA-N
MW502.66 g/mol
LogP6.96
Rot. Bonds8

About 4-[4,5-bis[4-(dimethylamino)phenyl]-1-(2-phenylethyl)imidazol-2-yl]phenol

4-[4,5-bis[4-(dimethylamino)phenyl]-1-(2-phenylethyl)imidazol-2-yl]phenol (PubChem CID 135734282) has the molecular formula C33H34N4O and a molecular weight of 502.66 g/mol. Its IUPAC name is 4-[4,5-bis[4-(dimethylamino)phenyl]-1-(2-phenylethyl)imidazol-2-yl]phenol.

Molecular Properties

Compound Name4-[4,5-bis[4-(dimethylamino)phenyl]-1-(2-phenylethyl)imidazol-2-yl]phenol
PubChem CID135734282
Molecular FormulaC33H34N4O
Molecular Weight502.66 g/mol
Exact Mass502.27
IUPAC Name4-[4,5-bis[4-(dimethylamino)phenyl]-1-(2-phenylethyl)imidazol-2-yl]phenol
SMILESCN(C)c1ccc(-c2nc(-c3ccc(O)cc3)n(CCc3ccccc3)c2-c2ccc(N(C)C)cc2)cc1
InChIInChI=1S/C33H34N4O/c1-35(2)28-16-10-25(11-17-28)31-32(26-12-18-29(19-13-26)36(3)4)37(23-22-24-8-6-5-7-9-24)33(34-31)27-14-20-30(38)21-15-27/h5-21,38H,22-23H2,1-4H3
InChIKeyQPHYPPILGXVHSR-UHFFFAOYSA-N
XLogP6.96
TPSA44.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms38
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500502.66
LogP ≤ 56.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-[4,5-bis[4-(dimethylamino)phenyl]-1-(2-phenylethyl)imidazol-2-yl]phenol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-[4,5-bis[4-(dimethylamino)phenyl]-1-(2-phenylethyl)imidazol-2-yl]phenol?
The IUPAC name of 4-[4,5-bis[4-(dimethylamino)phenyl]-1-(2-phenylethyl)imidazol-2-yl]phenol (CID 135734282) is 4-[4,5-bis[4-(dimethylamino)phenyl]-1-(2-phenylethyl)imidazol-2-yl]phenol.
What is the SMILES notation for 4-[4,5-bis[4-(dimethylamino)phenyl]-1-(2-phenylethyl)imidazol-2-yl]phenol?
The canonical SMILES for 4-[4,5-bis[4-(dimethylamino)phenyl]-1-(2-phenylethyl)imidazol-2-yl]phenol is CN(C)c1ccc(-c2nc(-c3ccc(O)cc3)n(CCc3ccccc3)c2-c2ccc(N(C)C)cc2)cc1.
What is the InChIKey of 4-[4,5-bis[4-(dimethylamino)phenyl]-1-(2-phenylethyl)imidazol-2-yl]phenol?
The InChIKey is QPHYPPILGXVHSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H34N4O/c1-35(2)28-16-10-25(11-17-28)31-32(26-12-18-29(19-13-26)36(3)4)37(23-22-24-8-6-5-7-9-24)33(34-31)27-14-20-30(38)21-15-27/h5-21,38H,22-23H2,1-4H3.
What are the key properties of 4-[4,5-bis[4-(dimethylamino)phenyl]-1-(2-phenylethyl)imidazol-2-yl]phenol?
4-[4,5-bis[4-(dimethylamino)phenyl]-1-(2-phenylethyl)imidazol-2-yl]phenol has a molecular weight of 502.66 g/mol, XLogP of 6.96, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4,5-bis[4-(dimethylamino)phenyl]-1-(2-phenylethyl)imidazol-2-yl]phenol is sourced from PubChem (CID 135734282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).