3-[4-(Azetidin-1-ylcarbonyl)-3-fluorophenoxy]-5-[(1S)-2-hydroxy-1-methylethoxy]-N-(1-methyl-1H-pyrazol-3-yl)benzamide
Basic information
- Standard SMILES
C[C@@H](CO)Oc1cc(Oc2ccc(C(=O)N3CCC3)c(F)c2)cc(C(=O)Nc2ccn(C)n2)c1- InChIKey
YINKJBQCZKBEJZ-HNNXBMFYSA-N- Molecular formula
- C24H25FN4O5
- Average molar mass
- 468.5 g/mol
Names & identifiers
- Preferred name
- 3-[4-(Azetidin-1-ylcarbonyl)-3-fluorophenoxy]-5-[(1S)-2-hydroxy-1-methylethoxy]-N-(1-methyl-1H-pyrazol-3-yl)benzamide
- IUPAC
- 3-[4-(azetidine-1-carbonyl)-3-fluorophenoxy]-5-[(2S)-1-hydroxypropan-2-yl]oxy-N-(1-methylpyrazol-3-yl)benzamide
Names & synonyms
SCHEMBL2659411YINKJBQCZKBEJZ-HNNXBMFYSA-N3-[4-(Azetidin-1-ylcarbonyl)-3-fluorophenoxy]-5-[(1S)-2-hydroxy-1-methylethoxy]-N-(1-methyl-1H-pyrazol-3-yl)benzamide
Database identifiers
- PubChem CID
- 11655726
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 106 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 8
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 711
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Related reactions
1 records
Compound notes
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