Basic information
- CAS
478039-63-3- Standard SMILES
O=C(C=Cc1cnc2ccccc2c1)NNc1ccc(Cl)cc1- InChIKey
AJUDOAHHBUOWBQ-UHFFFAOYSA-N- Molecular formula
- C18H14ClN3O
- Average molar mass
- 323.8 g/mol
Names & identifiers
- Preferred name
- N'-(4-chlorophenyl)-3-quinolin-3-ylprop-2-enehydrazide
- IUPAC
- N'-(4-chlorophenyl)-3-quinolin-3-ylprop-2-enehydrazide
- English name
- (E)-N'-(4-Chlorophenyl)-3-(3-quinolinyl)-2-propenohydrazide
- Molecular formula
- C18H14ClN3O
- Molecular weight
- 323.78
Names & synonyms
(E)-N'-(4-Chlorophenyl)-3-(3-quinolinyl)-2-propenohydrazide(2E)-N'-(4-chlorophenyl)-3-(quinolin-3-yl)prop-2-enehydrazide2-Propenoic acid, 3-(3-quinolinyl)-, 2-(4-chlorophenyl)hydrazide
Database identifiers
- CAS
478039-63-3
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 54 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 420
Physicochemical properties
- Boiling point
- 479.7 · 479.7±45.0 °C(Predicted)
- Density
- 1.351 · 1.351±0.06 g/cm3(Predicted)
- pka
- 11.37 · 11.37±0.43(Predicted)
Chemistry & industry
Suppliers3 total
Ryan Scientific, Inc.[email protected]
Key Organics Ltd.[email protected]
BIONET-INTER[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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