Basic information
- CAS
515831-53-5- Standard SMILES
Cc1nn(C)c(C(=O)Nc2ccon2)c1Cl- InChIKey
HAEBBRYFVSZIKE-UHFFFAOYSA-N- Molecular formula
- C9H9ClN4O2
- Average molar mass
- 240.64 g/mol
- Monoisotopic mass
- 240.0414032
Names & identifiers
- Preferred name
- 1H-Pyrazole-5-carboxamide, 4-chloro-N-3-isoxazolyl-1,3-dimethyl-
- IUPAC
- 4-chloro-1,3-dimethyl-N-(1,2-oxazol-3-yl)pyrazole-5-carboxamide
Names & synonyms
515831-53-51H-Pyrazole-5-carboxamide, 4-chloro-N-3-isoxazolyl-1,3-dimethyl-RefChem:2400624-Chloro-1,3-dimethyl-N-(1,2-oxazol-3-yl)-1H-pyrazole-5-carboxamideOprea1_101098DTXSID501170596AKOS003796552AK-968/419268344-chloro-N-(3-isoxazolyl)-1,3-dimethyl-1H-pyrazole-5-carboxamide
Database identifiers
- CAS
515831-53-5- PubChem CID
- 844752
- DTXSID
DTXSID501170596
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 73 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 278
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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