Basic information
- Standard SMILES
Cl.O=C(Nc1ccc([C@H]2CNCCO2)cc1Cl)c1cnn(-c2cncc(C(F)(F)F)n2)c1- InChIKey
OHMXJKBZNVFQCK-XFULWGLBSA-N- Molecular formula
- C19H17Cl2F3N6O2
- Average molar mass
- 489.3 g/mol
- Monoisotopic mass
- 488.0742137
Names & identifiers
- Preferred name
- (S)-N-(2-Chloro-4-(morpholin-2-yl)phenyl)-1-(6-(trifluoromethyl)pyrazin-2-yl)-1H-pyrazole-4-carboxamide hydrochloride
- IUPAC
- N-[2-chloro-4-[(2S)-morpholin-2-yl]phenyl]-1-[6-(trifluoromethyl)pyrazin-2-yl]pyrazole-4-carboxamide;hydrochloride
Names & synonyms
(S)-N-(2-Chloro-4-(morpholin-2-yl)phenyl)-1-(6-(trifluoromethyl)pyrazin-2-yl)-1H-pyrazole-4-carboxamide hydrochlorideSCHEMBL14150919
Database identifiers
- PubChem CID
- 71086955
Properties
Computed structural properties
- Topological polar surface area
- 94 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 4
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 630
Related reactions
1 records
Compound notes
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