Salicylaldehyde isonicotinoyl hydrazone
Basic information
- CAS
495-84-1- Standard SMILES
O=C(NN=Cc1ccccc1O)c1ccncc1- InChIKey
VBIZUNYMJSPHBH-UHFFFAOYSA-N- Molecular formula
- C13H11N3O2
- Average molar mass
- 241.24 g/mol
- Monoisotopic mass
- 241.0851266
Overview
structure in first source
Names & identifiers
- Preferred name
- Salicylaldehyde isonicotinoyl hydrazone
- IUPAC
- N-[(2-hydroxyphenyl)methylideneamino]pyridine-4-carboxamide
- English name
- Isonicotinic acid (2-hydroxy-benzylidene)-hydrazide
- Molecular formula
- C13H11N3O2
- Molecular weight
- 241.25
Names & synonyms
salicylaldehyde isonicotinoyl hydrazoneSIH cpdRefChem:931164N'-[(2-HYDROXYPHENYL)METHYLIDENE]PYRIDINE-4-CARBOHYDRAZIDEN-[(2-hydroxyphenyl)methylideneamino]pyridine-4-carboxamideIsonicotinic acid(2-hydroxy-benzylidene)-hydrazideCBDivE_001657SCHEMBL564003SCHEMBL1649834SCHEMBL2994770SCHEMBL2994771VBIZUNYMJSPHBH-UHFFFAOYSA-N
Show more names
SIHAT-1ITXSIH1ACATNNilazidNupasalSalizidSalizideSalinazid
HMS2231I23HMS3371L08Salinazid 100 |Ig/mL in AcetonitrileSalinazid 100 microg/mL in AcetonitrileSY465767DB-051650A3595N inverted exclamation mark -(2-Hydroxybenzylidene)isonicotinohydrazide
Database identifiers
- CAS
495-84-1- PubChem CID
- 10323
- DTXSID
DTXSID0046272
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 74.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 301
Physicochemical properties
- Melting point
- 232 · 232-233° (also given as 251°)
- storage temp.
- -196 °C · -196°C
- solubility
- 10 mg/ml,DMF:PBS · DMF: 10 mg/ml,DMF:PBS (pH 7.2) (1:3): 0.23 mg/ml,DMSO: 5 mg/ml
- form
- A crystalline solid
- color
- White to off-white
- InChI
- InChI=1S/C13H11N3O2/c17-12-4-2-1-3-11(12)9-15-16-13(18)10-5-7-14-8-6-10/h1-9,17H,(H,16,18)
- InChIKey
- VBIZUNYMJSPHBH-UHFFFAOYSA-N
- SMILES
- C1=NC=CC(C(NN=CC2=CC=CC=C2O)=O)=C1
- CAS DataBase Reference
- 495 · 495-84-1(CAS DataBase Reference)
- FDA UNII
- 2 H42W1O4O2 · 2H42W1O4O2
Chemistry & industry
Applications
UsesSalinazid is an antituberculous compound[1].
Additional notes
DefinitionChEBI: Salinazid is an aromatic carboxylic acid and a pyridinemonocarboxylic acid.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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