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3-(5-Chloro-2-methylphenyl)-1-methyl-2-thioxo-imidazolidin-4-one

HCID 18968209
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
Cc1ccc(Cl)cc1N1C(=O)CN(C)C1=S
InChIKey
FKVLPQQMNPAKDQ-UHFFFAOYSA-N
Molecular formula
C11H11ClN2OS
Average molar mass
254.74 g/mol
Monoisotopic mass
254.0280618

Names & identifiers

Preferred name
3-(5-Chloro-2-methylphenyl)-1-methyl-2-thioxo-imidazolidin-4-one
IUPAC
3-(5-chloro-2-methylphenyl)-1-methyl-2-sulfanylideneimidazolidin-4-one

Names & synonyms

SCHEMBL8661948FKVLPQQMNPAKDQ-UHFFFAOYSA-N3-(5-Chloro-2-methylphenyl)-1-methyl-2-thioxo-imidazolidin-4-one

Database identifiers

PubChem CID
18968209

Properties

Computed structural properties

XLogP
2.5
Topological polar surface area
55.6 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
1
Heavy atoms
16
Formal charge
0
Complexity
323

Related reactions

3 records
New reaction record
HRID 306762 reaction equation
HRID 306762As productTraining data from https://doi.org/10.1039/C8SC04228D (8/10)
HRID 399595 reaction equation
HRID 399595As productuspto-grants-1998_10
HRID 742224 reaction equation
HRID 742224As productuspto-grants-1996_09

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes