1-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]imidazolidine-2,4-dione

C12H8ClN3O2S — CID 3060461

IUPAC1-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]imidazolidine-2,4-dione
SMILESO=C1CN(c2nc(-c3ccc(Cl)cc3)cs2)C(=O)N1
InChIInChI=1S/C12H8ClN3O2S/c13-8-3-1-7(2-4-8)9-6-19-12(14-9)16-5-10(17)15-11(16)18/h1-4,6H,5H2,(H,15,17,18)
InChIKeyFMZPDJQVMCMLMT-UHFFFAOYSA-N
MW293.74 g/mol
LogP2.52
Rot. Bonds2

About 1-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]imidazolidine-2,4-dione

1-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]imidazolidine-2,4-dione (PubChem CID 3060461) has the molecular formula C12H8ClN3O2S and a molecular weight of 293.74 g/mol. Its IUPAC name is 1-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]imidazolidine-2,4-dione.

Molecular Properties

Compound Name1-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]imidazolidine-2,4-dione
PubChem CID3060461
Molecular FormulaC12H8ClN3O2S
Molecular Weight293.74 g/mol
Exact Mass293.00
IUPAC Name1-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]imidazolidine-2,4-dione
SMILESO=C1CN(c2nc(-c3ccc(Cl)cc3)cs2)C(=O)N1
InChIInChI=1S/C12H8ClN3O2S/c13-8-3-1-7(2-4-8)9-6-19-12(14-9)16-5-10(17)15-11(16)18/h1-4,6H,5H2,(H,15,17,18)
InChIKeyFMZPDJQVMCMLMT-UHFFFAOYSA-N
XLogP2.52
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.74
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]acetamide
CID 346935
4-(4-Chlorophenyl)-N-2-propen-1-yl-2-thiazolamine
CID 2131650
3-(4-Phenyl-1,3-thiazol-2-yl)-2-thioxo-4-imidazolidinone
CID 899465
N-benzyl-N'-(4-phenyl-1,3-thiazol-2-yl)oxamide
CID 1830730
2-(2,5-dioxopyrrolidin-1-yl)-N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]acetamide
CID 4175212
N-[4-(4-Chloro-phenyl)-thiazol-2-yl]-N-methyl-acetamide
CID 650025
Ethyl 4-(4-(4-chlorophenyl)thiazol-2-yl)piperazine-1-carboxylate
CID 1269494
N-[4-(3,4-dichlorophenyl)-1,3-thiazol-2-yl]acetamide
CID 4542330
4-chloro-N-(4-(2-oxo-2-(4-(2-oxo-2-(pyrrolidin-1-yl)ethyl)piperazin-1-yl)ethyl)thiazol-2-yl)benzamide
CID 42643068
2-chloro-N-[4-(3,4-dichlorophenyl)-1,3-thiazol-2-yl]-N-(prop-2-en-1-yl)acetamide
CID 9291140
N-(4-Phenylthiazol-2-yl)-2-(piperidin-1-yl)acetamide
CID 2336975
N-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]propanamide
CID 3143144

Frequently Asked Questions

What is the IUPAC name of 1-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]imidazolidine-2,4-dione?
The IUPAC name of 1-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]imidazolidine-2,4-dione (CID 3060461) is 1-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]imidazolidine-2,4-dione.
What is the SMILES notation for 1-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]imidazolidine-2,4-dione?
The canonical SMILES for 1-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]imidazolidine-2,4-dione is O=C1CN(c2nc(-c3ccc(Cl)cc3)cs2)C(=O)N1.
What is the InChIKey of 1-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]imidazolidine-2,4-dione?
The InChIKey is FMZPDJQVMCMLMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8ClN3O2S/c13-8-3-1-7(2-4-8)9-6-19-12(14-9)16-5-10(17)15-11(16)18/h1-4,6H,5H2,(H,15,17,18).
What are the key properties of 1-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]imidazolidine-2,4-dione?
1-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]imidazolidine-2,4-dione has a molecular weight of 293.74 g/mol, XLogP of 2.52, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]imidazolidine-2,4-dione is sourced from PubChem (CID 3060461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).