Basic information
- Standard SMILES
CN(CCO)c1ncc(C(=O)Nc2ccc(OC(F)(F)Cl)cc2)cc1-c1ccn[nH]1- InChIKey
NORIWUZJWHHBCV-UHFFFAOYSA-N- Molecular formula
- C19H18ClF2N5O3
- Average molar mass
- 437.8 g/mol
Names & identifiers
- Preferred name
- N-(4-(Chlorodifluoromethoxy)phenyl)-6-((2-hydroxyethyl)(methyl)amino)-5-(1H-pyrazol-5-yl)nicotinamide
- IUPAC
- N-[4-[chloro(difluoro)methoxy]phenyl]-6-[2-hydroxyethyl(methyl)amino]-5-(1H-pyrazol-5-yl)pyridine-3-carboxamide
Names & synonyms
N-(4-(Chlorodifluoromethoxy)phenyl)-6-((2-hydroxyethyl)(methyl)amino)-5-(1H-pyrazol-5-yl)nicotinamideCHEMBL3985022SCHEMBL15393563BDBM230769US9340537, 23
Database identifiers
- PubChem CID
- 89908438
- ChEMBL
CHEMBL3985022
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 103 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 8
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 568
Related reactions
1 records
Compound notes
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