3,6-dichloro-N-[(5-ethylthiophen-2-yl)methylideneamino]-1-benzothiophene-2-carboxamide
Basic information
- CAS
524927-13-7- Standard SMILES
CCc1ccc(C=NNC(=O)c2sc3cc(Cl)ccc3c2Cl)s1- InChIKey
JPFAFBHLBZYLJQ-UHFFFAOYSA-N- Molecular formula
- C16H12Cl2N2OS2
- Average molar mass
- 383.3 g/mol
Names & identifiers
- Preferred name
- 3,6-dichloro-N-[(5-ethylthiophen-2-yl)methylideneamino]-1-benzothiophene-2-carboxamide
- IUPAC
- 3,6-dichloro-N-[(5-ethylthiophen-2-yl)methylideneamino]-1-benzothiophene-2-carboxamide
- English name
- 3,6-dichloro-N'-[(5-ethyl-2-thienyl)methylene]-1-benzothiophene-2-carbohydrazide
- Molecular formula
- C16H12Cl2N2OS2
- Molecular weight
- 383.32
Names & synonyms
3,6-dichloro-N'-[(5-ethyl-2-thienyl)methylene]-1-benzothiophene-2-carbohydrazide
Database identifiers
- CAS
524927-13-7
Properties
Computed structural properties
- XLogP
- 6.3
- Topological polar surface area
- 97.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 465
Physicochemical properties
- Density
- 1.485 · 1.485±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 10.225 · 10.225±0.46(predicted)
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Compound notes
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