(5R)-5-(2,5-difluorophenyl)-5-methyl-3-[(2-phenoxyphenyl)methyl]imidazolidine-2,4-dione

C23H18F2N2O3 — CID 7562134

IUPAC(5R)-5-(2,5-difluorophenyl)-5-methyl-3-[(2-phenoxyphenyl)methyl]imidazolidine-2,4-dione
SMILESC[C@]1(c2cc(F)ccc2F)NC(=O)N(Cc2ccccc2Oc2ccccc2)C1=O
InChIInChI=1S/C23H18F2N2O3/c1-23(18-13-16(24)11-12-19(18)25)21(28)27(22(29)26-23)14-15-7-5-6-10-20(15)30-17-8-3-2-4-9-17/h2-13H,14H2,1H3,(H,26,29)/t23-/m1/s1
InChIKeyYOPJQABZHPUBOV-HSZRJFAPSA-N
MW408.40 g/mol
LogP4.72
Rot. Bonds5

About (5R)-5-(2,5-difluorophenyl)-5-methyl-3-[(2-phenoxyphenyl)methyl]imidazolidine-2,4-dione

(5R)-5-(2,5-difluorophenyl)-5-methyl-3-[(2-phenoxyphenyl)methyl]imidazolidine-2,4-dione (PubChem CID 7562134) has the molecular formula C23H18F2N2O3 and a molecular weight of 408.40 g/mol. Its IUPAC name is (5R)-5-(2,5-difluorophenyl)-5-methyl-3-[(2-phenoxyphenyl)methyl]imidazolidine-2,4-dione.

Molecular Properties

Compound Name(5R)-5-(2,5-difluorophenyl)-5-methyl-3-[(2-phenoxyphenyl)methyl]imidazolidine-2,4-dione
PubChem CID7562134
Molecular FormulaC23H18F2N2O3
Molecular Weight408.40 g/mol
Exact Mass408.13
IUPAC Name(5R)-5-(2,5-difluorophenyl)-5-methyl-3-[(2-phenoxyphenyl)methyl]imidazolidine-2,4-dione
SMILESC[C@]1(c2cc(F)ccc2F)NC(=O)N(Cc2ccccc2Oc2ccccc2)C1=O
InChIInChI=1S/C23H18F2N2O3/c1-23(18-13-16(24)11-12-19(18)25)21(28)27(22(29)26-23)14-15-7-5-6-10-20(15)30-17-8-3-2-4-9-17/h2-13H,14H2,1H3,(H,26,29)/t23-/m1/s1
InChIKeyYOPJQABZHPUBOV-HSZRJFAPSA-N
XLogP4.72
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500408.40
LogP ≤ 54.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

Sorbinil
CID 337359
6-Fluoro-4-chromanone hydantoin
CID 5252
E 0722
CID 175915
3-[2-(4-Methoxyphenyl)-2-oxoethyl]-5,5-diphenylimidazolidine-2,4-dione
CID 8005518
2-(2,4-dioxo-1,3-diazaspiro[4.6]undecan-3-yl)-N-[(2-methoxyphenyl)methyl]acetamide
CID 2550380
N-carbamoyl-2-(2',5'-dioxospiro[2,3-dihydrochromene-4,4'-imidazolidine]-1'-yl)acetamide
CID 3270671
2-(2',5'-dioxospiro[2,3-dihydrochromene-4,4'-imidazolidine]-1'-yl)-N-[2-(4-fluorophenyl)ethyl]acetamide
CID 3958821
2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-[2-(4-methoxyphenyl)ethyl]acetamide
CID 3984307
2-(2',5'-dioxospiro[2,3-dihydrochromene-4,4'-imidazolidine]-1'-yl)-N-(2-methoxyethyl)acetamide
CID 4428247
2-(2',5'-dioxospiro[2,3-dihydrochromene-4,4'-imidazolidine]-1'-yl)-N-(methylcarbamoyl)acetamide
CID 4876845
3-[2-(2,6-Dimethylphenoxy)ethyl]-5-methyl-5-phenylimidazolidine-2,4-dione
CID 4878039
2-(4-benzyl-2,5-dioxo-4-phenylimidazolidin-1-yl)-N-[(2-methoxyphenyl)methyl]acetamide
CID 16229687

Frequently Asked Questions

What is the IUPAC name of (5R)-5-(2,5-difluorophenyl)-5-methyl-3-[(2-phenoxyphenyl)methyl]imidazolidine-2,4-dione?
The IUPAC name of (5R)-5-(2,5-difluorophenyl)-5-methyl-3-[(2-phenoxyphenyl)methyl]imidazolidine-2,4-dione (CID 7562134) is (5R)-5-(2,5-difluorophenyl)-5-methyl-3-[(2-phenoxyphenyl)methyl]imidazolidine-2,4-dione.
What is the SMILES notation for (5R)-5-(2,5-difluorophenyl)-5-methyl-3-[(2-phenoxyphenyl)methyl]imidazolidine-2,4-dione?
The canonical SMILES for (5R)-5-(2,5-difluorophenyl)-5-methyl-3-[(2-phenoxyphenyl)methyl]imidazolidine-2,4-dione is C[C@]1(c2cc(F)ccc2F)NC(=O)N(Cc2ccccc2Oc2ccccc2)C1=O.
What is the InChIKey of (5R)-5-(2,5-difluorophenyl)-5-methyl-3-[(2-phenoxyphenyl)methyl]imidazolidine-2,4-dione?
The InChIKey is YOPJQABZHPUBOV-HSZRJFAPSA-N. The full InChI is InChI=1S/C23H18F2N2O3/c1-23(18-13-16(24)11-12-19(18)25)21(28)27(22(29)26-23)14-15-7-5-6-10-20(15)30-17-8-3-2-4-9-17/h2-13H,14H2,1H3,(H,26,29)/t23-/m1/s1.
What are the key properties of (5R)-5-(2,5-difluorophenyl)-5-methyl-3-[(2-phenoxyphenyl)methyl]imidazolidine-2,4-dione?
(5R)-5-(2,5-difluorophenyl)-5-methyl-3-[(2-phenoxyphenyl)methyl]imidazolidine-2,4-dione has a molecular weight of 408.40 g/mol, XLogP of 4.72, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-5-(2,5-difluorophenyl)-5-methyl-3-[(2-phenoxyphenyl)methyl]imidazolidine-2,4-dione is sourced from PubChem (CID 7562134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).