5-(4-fluorophenyl)-3-[[2-(4-fluorophenyl)-1,3-thiazol-4-yl]methyl]-5-methylimidazolidine-2,4-dione

C20H15F2N3O2S — CID 16612114

IUPAC5-(4-fluorophenyl)-3-[[2-(4-fluorophenyl)-1,3-thiazol-4-yl]methyl]-5-methylimidazolidine-2,4-dione
SMILESCC1(c2ccc(F)cc2)NC(=O)N(Cc2csc(-c3ccc(F)cc3)n2)C1=O
InChIInChI=1S/C20H15F2N3O2S/c1-20(13-4-8-15(22)9-5-13)18(26)25(19(27)24-20)10-16-11-28-17(23-16)12-2-6-14(21)7-3-12/h2-9,11H,10H2,1H3,(H,24,27)
InChIKeyDLAPIJORYDZIAZ-UHFFFAOYSA-N
MW399.42 g/mol
LogP4.06
Rot. Bonds4

About 5-(4-fluorophenyl)-3-[[2-(4-fluorophenyl)-1,3-thiazol-4-yl]methyl]-5-methylimidazolidine-2,4-dione

5-(4-fluorophenyl)-3-[[2-(4-fluorophenyl)-1,3-thiazol-4-yl]methyl]-5-methylimidazolidine-2,4-dione (PubChem CID 16612114) has the molecular formula C20H15F2N3O2S and a molecular weight of 399.42 g/mol. Its IUPAC name is 5-(4-fluorophenyl)-3-[[2-(4-fluorophenyl)-1,3-thiazol-4-yl]methyl]-5-methylimidazolidine-2,4-dione.

Molecular Properties

Compound Name5-(4-fluorophenyl)-3-[[2-(4-fluorophenyl)-1,3-thiazol-4-yl]methyl]-5-methylimidazolidine-2,4-dione
PubChem CID16612114
Molecular FormulaC20H15F2N3O2S
Molecular Weight399.42 g/mol
Exact Mass399.09
IUPAC Name5-(4-fluorophenyl)-3-[[2-(4-fluorophenyl)-1,3-thiazol-4-yl]methyl]-5-methylimidazolidine-2,4-dione
SMILESCC1(c2ccc(F)cc2)NC(=O)N(Cc2csc(-c3ccc(F)cc3)n2)C1=O
InChIInChI=1S/C20H15F2N3O2S/c1-20(13-4-8-15(22)9-5-13)18(26)25(19(27)24-20)10-16-11-28-17(23-16)12-2-6-14(21)7-3-12/h2-9,11H,10H2,1H3,(H,24,27)
InChIKeyDLAPIJORYDZIAZ-UHFFFAOYSA-N
XLogP4.06
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500399.42
LogP ≤ 54.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5-(4-fluorophenyl)-3-[[2-(4-fluorophenyl)-1,3-thiazol-4-yl]methyl]-5-methylimidazolidine-2,4-dione?
The IUPAC name of 5-(4-fluorophenyl)-3-[[2-(4-fluorophenyl)-1,3-thiazol-4-yl]methyl]-5-methylimidazolidine-2,4-dione (CID 16612114) is 5-(4-fluorophenyl)-3-[[2-(4-fluorophenyl)-1,3-thiazol-4-yl]methyl]-5-methylimidazolidine-2,4-dione.
What is the SMILES notation for 5-(4-fluorophenyl)-3-[[2-(4-fluorophenyl)-1,3-thiazol-4-yl]methyl]-5-methylimidazolidine-2,4-dione?
The canonical SMILES for 5-(4-fluorophenyl)-3-[[2-(4-fluorophenyl)-1,3-thiazol-4-yl]methyl]-5-methylimidazolidine-2,4-dione is CC1(c2ccc(F)cc2)NC(=O)N(Cc2csc(-c3ccc(F)cc3)n2)C1=O.
What is the InChIKey of 5-(4-fluorophenyl)-3-[[2-(4-fluorophenyl)-1,3-thiazol-4-yl]methyl]-5-methylimidazolidine-2,4-dione?
The InChIKey is DLAPIJORYDZIAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15F2N3O2S/c1-20(13-4-8-15(22)9-5-13)18(26)25(19(27)24-20)10-16-11-28-17(23-16)12-2-6-14(21)7-3-12/h2-9,11H,10H2,1H3,(H,24,27).
What are the key properties of 5-(4-fluorophenyl)-3-[[2-(4-fluorophenyl)-1,3-thiazol-4-yl]methyl]-5-methylimidazolidine-2,4-dione?
5-(4-fluorophenyl)-3-[[2-(4-fluorophenyl)-1,3-thiazol-4-yl]methyl]-5-methylimidazolidine-2,4-dione has a molecular weight of 399.42 g/mol, XLogP of 4.06, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-fluorophenyl)-3-[[2-(4-fluorophenyl)-1,3-thiazol-4-yl]methyl]-5-methylimidazolidine-2,4-dione is sourced from PubChem (CID 16612114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).