(R)-3-acetyl-N-(2-(3-(3-chloro-4-cyano-2-methylphenyl)-1H-pyrazol-1-yl)propyl)-1H-pyrazole-5-carboxamide
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Basic information
- Standard SMILES
CC(=O)c1cc(C(=O)NC[C@@H](C)n2ccc(-c3ccc(C#N)c(Cl)c3C)n2)[nH]n1- InChIKey
OXXRTGWLOQWLIX-LLVKDONJSA-N- Molecular formula
- C20H19ClN6O2
- Average molar mass
- 410.9 g/mol
Names & identifiers
- Preferred name
- (R)-3-acetyl-N-(2-(3-(3-chloro-4-cyano-2-methylphenyl)-1H-pyrazol-1-yl)propyl)-1H-pyrazole-5-carboxamide
- IUPAC
- 3-acetyl-N-[(2R)-2-[3-(3-chloro-4-cyano-2-methylphenyl)pyrazol-1-yl]propyl]-1H-pyrazole-5-carboxamide
Names & synonyms
SCHEMBL12079807OXXRTGWLOQWLIX-LLVKDONJSA-N(R)-3-acetyl-N-(2-(3-(3-chloro-4-cyano-2-methylphenyl)-1H-pyrazol-1-yl)propyl)-1H-pyrazole-5-carboxamide
Database identifiers
- PubChem CID
- 70656142
Properties
Computed structural propertiesFilling in
- XLogP
- 2.6
- Topological polar surface area
- 116 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 667
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Related reactions
1 records
Compound notes
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