Basic information
- CAS
956264-15-6- Standard SMILES
Cn1ccc(NC(=O)c2ccc(Cl)cc2Cl)n1- InChIKey
DHIYFBKOBPPKQN-UHFFFAOYSA-N- Molecular formula
- C11H9Cl2N3O
- Average molar mass
- 270.11 g/mol
- Monoisotopic mass
- 269.0122673
Names & identifiers
- Preferred name
- 2,4-Dichloro-N-(1-methyl-1H-pyrazol-3-yl)benzamide
- IUPAC
- 2,4-dichloro-N-(1-methylpyrazol-3-yl)benzamide
Names & synonyms
2,4-dichloro-N-(1-methyl-1H-pyrazol-3-yl)benzamide956264-15-6RefChem:246319MLS001360047CHEMBL1476905DTXSID201226637HMS3059C05STL401620AKOS002594317SMR001224233ST080475Z108545614
Show more names
(2,4-dichlorophenyl)-N-(1-methylpyrazol-3-yl)carboxamide
Database identifiers
- CAS
956264-15-6- PubChem CID
- 4862736
- DTXSID
DTXSID201226637- ChEMBL
CHEMBL1476905
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 46.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 290
Experimental & physicochemical properties
Solubility34.3 [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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