Basic information
- Standard SMILES
Cl.N#Cc1ccc(-n2cc(C(=O)Nc3ccc([C@H]4CNCCO4)cc3Cl)cn2)cc1- InChIKey
UKKGCFIDOWJRNX-VEIFNGETSA-N- Molecular formula
- C21H19Cl2N5O2
- Average molar mass
- 444.3 g/mol
Names & identifiers
- Preferred name
- (S)-N-(2-Chloro-4-(morpholin-2-yl)phenyl)-1-(4-cyanophenyl)-1H-pyrazole-4-carboxamide hydrochloride
- IUPAC
- N-[2-chloro-4-[(2S)-morpholin-2-yl]phenyl]-1-(4-cyanophenyl)pyrazole-4-carboxamide;hydrochloride
Names & synonyms
SCHEMBL14150749UKKGCFIDOWJRNX-VEIFNGETSA-N(S)-N-(2-Chloro-4-(morpholin-2-yl)phenyl)-1-(4-cyanophenyl)-1H-pyrazole-4-carboxamide hydrochloride
Database identifiers
- PubChem CID
- 71086869
Properties
Computed structural properties
- Topological polar surface area
- 92 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 617
Related reactions
1 records
Compound notes
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