Basic information
- CAS
1285681-86-8- Standard SMILES
O=C(N/N=C/c1ccc(O)cc1)c1cc(-c2ccc(Cl)cc2Cl)[nH]n1- InChIKey
NMKFICHZHAJPMS-AWQFTUOYSA-N- Molecular formula
- C17H12Cl2N4O2
- Average molar mass
- 375.2 g/mol
- Monoisotopic mass
- 374.033731
Names & identifiers
- Preferred name
- (E)-3-(2,4-Dichlorophenyl)-N'-(4-hydroxybenzylidene)-1H-pyrazole-5-carbohydrazide
- IUPAC
- 3-(2,4-dichlorophenyl)-N-[(E)-(4-hydroxyphenyl)methylideneamino]-1H-pyrazole-5-carboxamide
- English name
- 3-(2,4-dichlorophenyl)-N'-[(E)-(4-hydroxyphenyl)methylidene]-1H-pyrazole-5-carbohydrazide
- Molecular formula
- C17H12Cl2N4O2
- Molecular weight
- 375.21
Names & synonyms
1285681-86-8(E)-3-(2,4-Dichlorophenyl)-N'-(4-hydroxybenzylidene)-1H-pyrazole-5-carbohydrazide3-(2,4-dichlorophenyl)-N'-[(E)-(4-hydroxyphenyl)methylidene]-1H-pyrazole-5-carbohydrazideSTK978841AKOS000558192ST50054209Z571687813-(2,4-DICHLOROPHENYL)-N'-(4-HYDROXYBENZYLIDENE)-1H-PYRAZOLE-5-CARBOHYDRAZIDE5-(2,4-Dichloro-phenyl)-2H-pyrazole-3-carboxylic acid (4-hydroxy-benzylidene)-hydrazideN-[(1E)-2-(4-hydroxyphenyl)-1-azavinyl][3-(2,4-dichlorophenyl)pyrazol-5-yl]car boxamide1H-Pyrazole-3-carboxylic acid, 5-(2,4-dichlorophenyl)-, (2E)-2-[(4-hydroxyphenyl)methylene]hydrazide
Database identifiers
- CAS
1285681-86-8- PubChem CID
- 135547185
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 90.4 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 485
Physicochemical properties
- Density
- 1.485 · 1.485±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 6.603 · 6.603±0.46(predicted)
Chemistry & industry
Suppliers4 total
PHARMEKS Ltd.[email protected]
Interbioscreen Ltd.[email protected]
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
VITAS-BB—
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…