5-chloro-N-[1-[4-[[2-(4-chlorophenyl)acetyl]amino]phenyl]ethylideneamino]thiophene-2-carboxamide
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Basic information
- CAS
445008-61-7- Standard SMILES
CC(=NNC(=O)c1ccc(Cl)s1)c1ccc(NC(=O)Cc2ccc(Cl)cc2)cc1- InChIKey
FUDBNQBFOSUNRJ-UHFFFAOYSA-N- Molecular formula
- C21H17Cl2N3O2S
- Average molar mass
- 446.3 g/mol
- Monoisotopic mass
- 445.0418534
Names & identifiers
- Preferred name
- 5-chloro-N-[1-[4-[[2-(4-chlorophenyl)acetyl]amino]phenyl]ethylideneamino]thiophene-2-carboxamide
- IUPAC
- 5-chloro-N-[1-[4-[[2-(4-chlorophenyl)acetyl]amino]phenyl]ethylideneamino]thiophene-2-carboxamide
- English name
- 2-(4-chlorophenyl)-N-(4-{N-[(5-chloro-2-thienyl)carbonyl]ethanehydrazonoyl}phenyl)acetamide
- Molecular formula
- C21H17Cl2N3O2S
- Molecular weight
- 446.35
Names & synonyms
2-(4-chlorophenyl)-N-(4-{N-[(5-chloro-2-thienyl)carbonyl]ethanehydrazonoyl}phenyl)acetamide
Database identifiers
- CAS
445008-61-7- PubChem CID
- 1225517
Properties
Computed structural propertiesFilling in
- XLogP
- 5.4
- Topological polar surface area
- 98.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 603
Physicochemical properties
- Density
- 1.37 · 1.370±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 11.587 · 11.587±0.46(predicted)
Related reactions
0 records
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Compound notes
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