1-(3H-benzimidazol-5-yl)-5-(3-phenylphenyl)imidazolidin-2-one

C22H18N4O — CID 58229098

IUPAC1-(3H-benzimidazol-5-yl)-5-(3-phenylphenyl)imidazolidin-2-one
SMILESO=C1NCC(c2cccc(-c3ccccc3)c2)N1c1ccc2nc[nH]c2c1
InChIInChI=1S/C22H18N4O/c27-22-23-13-21(26(22)18-9-10-19-20(12-18)25-14-24-19)17-8-4-7-16(11-17)15-5-2-1-3-6-15/h1-12,14,21H,13H2,(H,23,27)(H,24,25)
InChIKeyBPMIYWJABFZDBX-UHFFFAOYSA-N
MW354.41 g/mol
LogP4.50
Rot. Bonds3

About 1-(3H-benzimidazol-5-yl)-5-(3-phenylphenyl)imidazolidin-2-one

1-(3H-benzimidazol-5-yl)-5-(3-phenylphenyl)imidazolidin-2-one (PubChem CID 58229098) has the molecular formula C22H18N4O and a molecular weight of 354.41 g/mol. Its IUPAC name is 1-(3H-benzimidazol-5-yl)-5-(3-phenylphenyl)imidazolidin-2-one.

Molecular Properties

Compound Name1-(3H-benzimidazol-5-yl)-5-(3-phenylphenyl)imidazolidin-2-one
PubChem CID58229098
Molecular FormulaC22H18N4O
Molecular Weight354.41 g/mol
Exact Mass354.15
IUPAC Name1-(3H-benzimidazol-5-yl)-5-(3-phenylphenyl)imidazolidin-2-one
SMILESO=C1NCC(c2cccc(-c3ccccc3)c2)N1c1ccc2nc[nH]c2c1
InChIInChI=1S/C22H18N4O/c27-22-23-13-21(26(22)18-9-10-19-20(12-18)25-14-24-19)17-8-4-7-16(11-17)15-5-2-1-3-6-15/h1-12,14,21H,13H2,(H,23,27)(H,24,25)
InChIKeyBPMIYWJABFZDBX-UHFFFAOYSA-N
XLogP4.50
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.41
LogP ≤ 54.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(4R)-1-(3H-benzimidazol-5-yl)-4-phenylazetidin-2-one
CID 138503619
1-(3H-benzimidazol-5-yl)-5-[4-[5-(trifluoromethyl)-1H-pyrrol-3-yl]phenyl]imidazolidin-2-one
CID 146439010
1-(3H-benzimidazol-5-yl)-5-tert-butylimidazolidin-2-one
CID 51030777
(4S)-3-(3H-benzimidazol-5-yl)-4-[4-(4-phenylpiperazin-1-yl)phenyl]-1,3-oxazolidin-2-one
CID 50939051
1-(3H-benzimidazol-5-yl)-5-[4-(5-chlorothiophen-2-yl)-3-fluorophenyl]imidazolidin-2-one
CID 146422669
(4S)-3-(3H-benzimidazol-5-yl)-4-(3-morpholin-4-ylphenyl)-1,3-oxazolidin-2-one
CID 58229168
3-(3H-benzimidazol-5-yl)-4-(3-piperidin-1-ylphenyl)-1,3-oxazolidin-2-one
CID 67036307
(4S)-3-(3H-benzimidazol-5-yl)-5,5-dimethyl-4-phenyl-1,3-oxazolidin-2-one
CID 51029940
3-(3H-benzimidazol-5-yl)-4-(4-chlorophenyl)-1,3-oxazolidin-2-one
CID 67036274
3-(3H-benzimidazol-5-yl)-5,5-dimethyl-4-phenyl-1,3-oxazolidin-2-one
CID 67036550
1-(3H-benzimidazol-5-yl)-5-[2,3-difluoro-4-[5-(methoxymethyl)-2,3-dihydrothiophen-3-yl]phenyl]imidazolidin-2-one
CID 165108458
3-(3H-benzimidazol-5-yl)-4-[4-(4-hydroxycyclohexyl)phenyl]-1,3-oxazolidin-2-one
CID 58229114

Frequently Asked Questions

What is the IUPAC name of 1-(3H-benzimidazol-5-yl)-5-(3-phenylphenyl)imidazolidin-2-one?
The IUPAC name of 1-(3H-benzimidazol-5-yl)-5-(3-phenylphenyl)imidazolidin-2-one (CID 58229098) is 1-(3H-benzimidazol-5-yl)-5-(3-phenylphenyl)imidazolidin-2-one.
What is the SMILES notation for 1-(3H-benzimidazol-5-yl)-5-(3-phenylphenyl)imidazolidin-2-one?
The canonical SMILES for 1-(3H-benzimidazol-5-yl)-5-(3-phenylphenyl)imidazolidin-2-one is O=C1NCC(c2cccc(-c3ccccc3)c2)N1c1ccc2nc[nH]c2c1.
What is the InChIKey of 1-(3H-benzimidazol-5-yl)-5-(3-phenylphenyl)imidazolidin-2-one?
The InChIKey is BPMIYWJABFZDBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18N4O/c27-22-23-13-21(26(22)18-9-10-19-20(12-18)25-14-24-19)17-8-4-7-16(11-17)15-5-2-1-3-6-15/h1-12,14,21H,13H2,(H,23,27)(H,24,25).
What are the key properties of 1-(3H-benzimidazol-5-yl)-5-(3-phenylphenyl)imidazolidin-2-one?
1-(3H-benzimidazol-5-yl)-5-(3-phenylphenyl)imidazolidin-2-one has a molecular weight of 354.41 g/mol, XLogP of 4.50, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3H-benzimidazol-5-yl)-5-(3-phenylphenyl)imidazolidin-2-one is sourced from PubChem (CID 58229098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).