6-chloro-N'-[2-(1-methylbenzimidazol-2-yl)acetyl]pyridine-3-carbohydrazide
Basic information
- CAS
794556-91-5- Standard SMILES
Cn1c(CC(=O)NNC(=O)c2ccc(Cl)nc2)nc2ccccc21- InChIKey
QPRILDPJZRNSFG-UHFFFAOYSA-N- Molecular formula
- C16H14ClN5O2
- Average molar mass
- 343.77 g/mol
- Monoisotopic mass
- 343.0836024
Names & identifiers
- Preferred name
- 6-chloro-N'-[2-(1-methylbenzimidazol-2-yl)acetyl]pyridine-3-carbohydrazide
- IUPAC
- 6-chloro-N'-[2-(1-methylbenzimidazol-2-yl)acetyl]pyridine-3-carbohydrazide
Names & synonyms
794556-91-56-chloro-N'-[2-(1-methylbenzimidazol-2-yl)acetyl]pyridine-3-carbohydrazideMLS002251171CHEMBL1700387DTXSID201324247HMS3094L05AKOS034198748SMR001313597EN300-26600955Z334803906-Chloro-N'-[(1-methyl-1H-benzimidazol-2-yl)acetyl]pyridine-3-carbohydrazide6-chloro-N'-[2-(1-methyl-1H-1,3-benzodiazol-2-yl)acetyl]pyridine-3-carbohydrazide
Database identifiers
- CAS
794556-91-5- PubChem CID
- 4877667
- DTXSID
DTXSID201324247- ChEMBL
CHEMBL1700387
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 88.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 477
Experimental & physicochemical properties
Solubility24.2 [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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