Basic information
- CAS
95173-77-6- Standard SMILES
O=C(NNC(=O)c1cnccn1)c1ccc(Cl)cc1- InChIKey
XMRUGQJFSZJSKG-UHFFFAOYSA-N- Molecular formula
- C12H9ClN4O2
- Average molar mass
- 276.68 g/mol
- Monoisotopic mass
- 276.0414032
Overview
N'-[(4-chlorophenyl)-oxomethyl]-2-pyrazinecarbohydrazide is an organohalogen compound and a carbonyl compound.
Names & identifiers
- Preferred name
- N'-[(4-chlorophenyl)-oxomethyl]-2-pyrazinecarbohydrazide
- IUPAC
- N'-(4-chlorobenzoyl)pyrazine-2-carbohydrazide
Names & synonyms
N'-(4-chlorobenzoyl)pyrazine-2-carbohydrazideMLS000332634N'-[(4-chlorophenyl)-oxomethyl]-2-pyrazinecarbohydrazideSMR0004359474-Chloro-benzoic acid N'-(pyrazine-2-carbonyl)-hydrazide95173-77-6cid_754530CHEMBL1533590BDBM52901CHEBI:116979DTXSID101330974HMS2781K23
Show more names
STK873409AKOS001467260N''-(4-chlorobenzoyl)pyrazinohydrazideN''-(4-chlorobenzoyl)pyrazine-2-carbohydrazideSR-01000084781SR-01000084781-1N''-(4-chlorophenyl)carbonylpyrazine-2-carbohydrazideQ27203598
Database identifiers
- CAS
95173-77-6- PubChem CID
- 754530
- DTXSID
DTXSID101330974- ChEMBL
CHEMBL1533590- ChEBI
CHEBI:116979
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 84 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 332
Experimental & physicochemical properties
Solubility27.1 [ug/mL] (The mean of the results at pH 7.4)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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