3-[(3,4-difluorophenyl)methyl]-5,5-diphenylimidazolidine-2,4-dione

C22H16F2N2O2 — CID 78797815

IUPAC3-[(3,4-difluorophenyl)methyl]-5,5-diphenylimidazolidine-2,4-dione
SMILESO=C1NC(c2ccccc2)(c2ccccc2)C(=O)N1Cc1ccc(F)c(F)c1
InChIInChI=1S/C22H16F2N2O2/c23-18-12-11-15(13-19(18)24)14-26-20(27)22(25-21(26)28,16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-13H,14H2,(H,25,28)
InChIKeyINXJNGONRKESPM-UHFFFAOYSA-N
MW378.38 g/mol
LogP3.96
Rot. Bonds4

About 3-[(3,4-difluorophenyl)methyl]-5,5-diphenylimidazolidine-2,4-dione

3-[(3,4-difluorophenyl)methyl]-5,5-diphenylimidazolidine-2,4-dione (PubChem CID 78797815) has the molecular formula C22H16F2N2O2 and a molecular weight of 378.38 g/mol. Its IUPAC name is 3-[(3,4-difluorophenyl)methyl]-5,5-diphenylimidazolidine-2,4-dione.

Molecular Properties

Compound Name3-[(3,4-difluorophenyl)methyl]-5,5-diphenylimidazolidine-2,4-dione
PubChem CID78797815
Molecular FormulaC22H16F2N2O2
Molecular Weight378.38 g/mol
Exact Mass378.12
IUPAC Name3-[(3,4-difluorophenyl)methyl]-5,5-diphenylimidazolidine-2,4-dione
SMILESO=C1NC(c2ccccc2)(c2ccccc2)C(=O)N1Cc1ccc(F)c(F)c1
InChIInChI=1S/C22H16F2N2O2/c23-18-12-11-15(13-19(18)24)14-26-20(27)22(25-21(26)28,16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-13H,14H2,(H,25,28)
InChIKeyINXJNGONRKESPM-UHFFFAOYSA-N
XLogP3.96
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.38
LogP ≤ 53.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}

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Related Compounds

3-[(4-methylphenyl)methyl]-5,5-diphenylimidazolidine-2,4-dione
CID 4810451
3-[(2,4-dichlorophenyl)methyl]-5,5-diphenylimidazolidine-2,4-dione
CID 4272734
3-[(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)methyl]-N,N-dimethylbenzamide
CID 52727040
3-[(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)methyl]-N,N-dimethylbenzenesulfonamide
CID 4794115
3-[(2-bromophenyl)methyl]-5,5-diphenylimidazolidine-2,4-dione
CID 26018170
3-[[(3-fluoro-4-methoxyphenyl)methyl-methylamino]methyl]-5,5-diphenylimidazolidine-2,4-dione
CID 31920090
(5S)-3-(1,3-benzodioxol-5-ylmethyl)-5-(3,4-dimethylphenyl)-5-phenylimidazolidine-2,4-dione
CID 9291310
4-[[(4S)-4-(3,4-dimethylphenyl)-2,5-dioxo-4-phenylimidazolidin-1-yl]methyl]benzonitrile
CID 8672971
3-(naphthalen-1-ylmethyl)-5,5-diphenylimidazolidine-2,4-dione
CID 7916945
1-[(3,4-difluorophenyl)methyl]imidazolidine-2,4,5-trione
CID 54965624
(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)methoxy-oxophosphanium
CID 173376528
(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)methyl-bis(2-methylpropyl)azanium
CID 9109602

Frequently Asked Questions

What is the IUPAC name of 3-[(3,4-difluorophenyl)methyl]-5,5-diphenylimidazolidine-2,4-dione?
The IUPAC name of 3-[(3,4-difluorophenyl)methyl]-5,5-diphenylimidazolidine-2,4-dione (CID 78797815) is 3-[(3,4-difluorophenyl)methyl]-5,5-diphenylimidazolidine-2,4-dione.
What is the SMILES notation for 3-[(3,4-difluorophenyl)methyl]-5,5-diphenylimidazolidine-2,4-dione?
The canonical SMILES for 3-[(3,4-difluorophenyl)methyl]-5,5-diphenylimidazolidine-2,4-dione is O=C1NC(c2ccccc2)(c2ccccc2)C(=O)N1Cc1ccc(F)c(F)c1.
What is the InChIKey of 3-[(3,4-difluorophenyl)methyl]-5,5-diphenylimidazolidine-2,4-dione?
The InChIKey is INXJNGONRKESPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H16F2N2O2/c23-18-12-11-15(13-19(18)24)14-26-20(27)22(25-21(26)28,16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-13H,14H2,(H,25,28).
What are the key properties of 3-[(3,4-difluorophenyl)methyl]-5,5-diphenylimidazolidine-2,4-dione?
3-[(3,4-difluorophenyl)methyl]-5,5-diphenylimidazolidine-2,4-dione has a molecular weight of 378.38 g/mol, XLogP of 3.96, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3,4-difluorophenyl)methyl]-5,5-diphenylimidazolidine-2,4-dione is sourced from PubChem (CID 78797815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).