2-[2-(3-chloro-2-methylphenyl)imino-3-methyl-4-oxo-1,3-thiazolidin-5-yl]-N-(3-chlorophenyl)acetamide
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Basic information
- CAS
503563-24-4- Standard SMILES
Cc1c(Cl)cccc1N=C1SC(CC(=O)Nc2cccc(Cl)c2)C(=O)N1C- InChIKey
FRACDLCLZLLKKV-UHFFFAOYSA-N- Molecular formula
- C19H17Cl2N3O2S
- Average molar mass
- 422.3 g/mol
- Monoisotopic mass
- 421.0418534
Names & identifiers
- Preferred name
- 2-[2-(3-chloro-2-methylphenyl)imino-3-methyl-4-oxo-1,3-thiazolidin-5-yl]-N-(3-chlorophenyl)acetamide
- IUPAC
- 2-[2-(3-chloro-2-methylphenyl)imino-3-methyl-4-oxo-1,3-thiazolidin-5-yl]-N-(3-chlorophenyl)acetamide
- English name
- 2-{2-[(3-chloro-2-methylphenyl)imino]-3-methyl-4-oxo-1,3-thiazolidin-5-yl}-N-(3-chlorophenyl)acetamide
- Molecular formula
- C19H17Cl2N3O2S
- Molecular weight
- 422.33
Names & synonyms
2-{2-[(3-chloro-2-methylphenyl)imino]-3-methyl-4-oxo-1,3-thiazolidin-5-yl}-N-(3-chlorophenyl)acetamide2-[2-(3-chloro-2-methylphenyl)imino-3-methyl-4-oxo-1,3-thiazolidin-5-yl]-N-(3-chlorophenyl)acetamideAG-670/40827221
Database identifiers
- CAS
503563-24-4- PubChem CID
- 5192560
Properties
Computed structural propertiesFilling in
- XLogP
- 4.6
- Topological polar surface area
- 87.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 604
Physicochemical properties
- Density
- 1.413 · 1.413±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 13.062 · 13.062±0.70(predicted)
Related reactions
0 records
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Compound notes
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