4-[(3-chlorophenyl)methyl]-2,4-diphenyl-1H-imidazol-5-one

C22H17ClN2O — CID 71698058

IUPAC4-[(3-chlorophenyl)methyl]-2,4-diphenyl-1H-imidazol-5-one
SMILESO=C1NC(c2ccccc2)=NC1(Cc1cccc(Cl)c1)c1ccccc1
InChIInChI=1S/C22H17ClN2O/c23-19-13-7-8-16(14-19)15-22(18-11-5-2-6-12-18)21(26)24-20(25-22)17-9-3-1-4-10-17/h1-14H,15H2,(H,24,25,26)
InChIKeyPWVANDUALYUCOZ-UHFFFAOYSA-N
MW360.84 g/mol
LogP4.35
Rot. Bonds4

About 4-[(3-chlorophenyl)methyl]-2,4-diphenyl-1H-imidazol-5-one

4-[(3-chlorophenyl)methyl]-2,4-diphenyl-1H-imidazol-5-one (PubChem CID 71698058) has the molecular formula C22H17ClN2O and a molecular weight of 360.84 g/mol. Its IUPAC name is 4-[(3-chlorophenyl)methyl]-2,4-diphenyl-1H-imidazol-5-one.

Molecular Properties

Compound Name4-[(3-chlorophenyl)methyl]-2,4-diphenyl-1H-imidazol-5-one
PubChem CID71698058
Molecular FormulaC22H17ClN2O
Molecular Weight360.84 g/mol
Exact Mass360.10
IUPAC Name4-[(3-chlorophenyl)methyl]-2,4-diphenyl-1H-imidazol-5-one
SMILESO=C1NC(c2ccccc2)=NC1(Cc1cccc(Cl)c1)c1ccccc1
InChIInChI=1S/C22H17ClN2O/c23-19-13-7-8-16(14-19)15-22(18-11-5-2-6-12-18)21(26)24-20(25-22)17-9-3-1-4-10-17/h1-14H,15H2,(H,24,25,26)
InChIKeyPWVANDUALYUCOZ-UHFFFAOYSA-N
XLogP4.35
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.84
LogP ≤ 54.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-[(4-chlorophenyl)methyl]-2-(4-methylphenyl)-4-phenyl-1H-imidazol-5-one
CID 71698156
(4R)-2-amino-4-[(4-chlorophenyl)methyl]-4-phenyl-1H-imidazol-5-one
CID 95655641
2-amino-4-benzyl-4-(3-nitrophenyl)-1H-imidazol-5-one
CID 75358707
2-[(3-chlorophenyl)methyl]-1,3-dihydroinden-2-ol
CID 60799487
3-bromo-3-[(3-chlorophenyl)methyl]-6-methyl-1H-indol-2-one
CID 59703601
2-(3-chlorophenyl)-5,5-diphenyl-1,4-dihydroimidazole
CID 139909403
1-[(3-chlorophenyl)methyl]cyclopentan-1-ol
CID 60798466
3-[(3-chlorophenyl)methyl]thietan-3-ol
CID 83689574
5-[(3-chlorophenyl)methyl]-5-methylpyrrolidin-2-one
CID 104687299
1-(benzylsulfinylmethyl)-3-chlorobenzene
CID 47022757
1-[(3-chlorophenyl)methyl]cycloheptan-1-ol
CID 60797404
2-[(3-chlorophenyl)methyl]-5-methyl-4-phenyl-1H-pyrazol-3-one
CID 22769211

Frequently Asked Questions

What is the IUPAC name of 4-[(3-chlorophenyl)methyl]-2,4-diphenyl-1H-imidazol-5-one?
The IUPAC name of 4-[(3-chlorophenyl)methyl]-2,4-diphenyl-1H-imidazol-5-one (CID 71698058) is 4-[(3-chlorophenyl)methyl]-2,4-diphenyl-1H-imidazol-5-one.
What is the SMILES notation for 4-[(3-chlorophenyl)methyl]-2,4-diphenyl-1H-imidazol-5-one?
The canonical SMILES for 4-[(3-chlorophenyl)methyl]-2,4-diphenyl-1H-imidazol-5-one is O=C1NC(c2ccccc2)=NC1(Cc1cccc(Cl)c1)c1ccccc1.
What is the InChIKey of 4-[(3-chlorophenyl)methyl]-2,4-diphenyl-1H-imidazol-5-one?
The InChIKey is PWVANDUALYUCOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17ClN2O/c23-19-13-7-8-16(14-19)15-22(18-11-5-2-6-12-18)21(26)24-20(25-22)17-9-3-1-4-10-17/h1-14H,15H2,(H,24,25,26).
What are the key properties of 4-[(3-chlorophenyl)methyl]-2,4-diphenyl-1H-imidazol-5-one?
4-[(3-chlorophenyl)methyl]-2,4-diphenyl-1H-imidazol-5-one has a molecular weight of 360.84 g/mol, XLogP of 4.35, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(3-chlorophenyl)methyl]-2,4-diphenyl-1H-imidazol-5-one is sourced from PubChem (CID 71698058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).