Basic information
- Standard SMILES
Cc1nnc(C(=O)N[C@@H](C)Cn2ccc(-c3ccc(C#N)c(Cl)c3)n2)o1- InChIKey
VGFKSCQVIWVWJH-JTQLQIEISA-N- Molecular formula
- C17H15ClN6O2
- Average molar mass
- 370.8 g/mol
Names & identifiers
- Preferred name
- (S)-N-(1-(3-(3-chloro-4-cyanophenyl)-1H-pyrazol-1-yl)propan-2-yl)-5-methyl-1,3,4-oxadiazole-2-carboxamide
- IUPAC
- N-[(2S)-1-[3-(3-chloro-4-cyanophenyl)pyrazol-1-yl]propan-2-yl]-5-methyl-1,3,4-oxadiazole-2-carboxamide
Names & synonyms
SCHEMBL12081208VGFKSCQVIWVWJH-JTQLQIEISA-N(S)-N-(1-(3-(3-chloro-4-cyanophenyl)-1H-pyrazol-1-yl)propan-2-yl)-5-methyl-1,3,4-oxadiazole-2-carboxamide
Database identifiers
- PubChem CID
- 70657245
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 110 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 555
Related reactions
1 records
Compound notes
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