(S)-N-(1-(3-(3-chloro-4-cyanophenyl)-1H-pyrazol-1-yl)propan-2-yl)-3-(pyridin-3-yl)-1,2,4-oxadiazole-5-carboxamide
Completing data — refresh the page later to see the latest
Basic information
- Standard SMILES
C[C@@H](Cn1ccc(-c2ccc(C#N)c(Cl)c2)n1)NC(=O)c1nc(-c2cccnc2)no1- InChIKey
BOSUTDUBXSHZOE-ZDUSSCGKSA-N- Molecular formula
- C21H16ClN7O2
- Average molar mass
- 433.8 g/mol
Names & identifiers
- Preferred name
- (S)-N-(1-(3-(3-chloro-4-cyanophenyl)-1H-pyrazol-1-yl)propan-2-yl)-3-(pyridin-3-yl)-1,2,4-oxadiazole-5-carboxamide
- IUPAC
- N-[(2S)-1-[3-(3-chloro-4-cyanophenyl)pyrazol-1-yl]propan-2-yl]-3-pyridin-3-yl-1,2,4-oxadiazole-5-carboxamide
Names & synonyms
CHEMBL6050965SCHEMBL12081395BOSUTDUBXSHZOE-ZDUSSCGKSA-NBDBM508521US11046713, Example 91(S)-N-(1-(3-(3-chloro-4-cyanophenyl)-1H-pyrazol-1-yl)propan-2-yl)-3-(pyridin-3-yl)-1,2,4-oxadiazole-5-carboxamide
Database identifiers
- PubChem CID
- 70657397
- ChEMBL
CHEMBL6050965
Properties
Computed structural propertiesFilling in
- XLogP
- 2.7
- Topological polar surface area
- 123 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 673
Related reactions
1 records
Compound notes
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