Basic information
- Standard SMILES
Cc1cnc(NC(=O)c2cc(Oc3ccc(C(=O)N4CCC4)cc3F)cc(O[C@@H](C)CO)c2)cn1- InChIKey
GFZFCWVETIZWEV-INIZCTEOSA-N- Molecular formula
- C25H25FN4O5
- Average molar mass
- 480.5 g/mol
Names & identifiers
- Preferred name
- 3-{[4-(Azetidin-1-ylcarbonyl)-2-fluorophenyl]oxy}-5-{[(1S)-2-hydroxy-1-methylethyl]oxy}-N-(5-methylpyrazin-2-yl)benzamide
- IUPAC
- 3-[4-(azetidine-1-carbonyl)-2-fluorophenoxy]-5-[(2S)-1-hydroxypropan-2-yl]oxy-N-(5-methylpyrazin-2-yl)benzamide
Names & synonyms
SCHEMBL2904507GFZFCWVETIZWEV-INIZCTEOSA-N3-{[4-(Azetidin-1-ylcarbonyl)-2-fluorophenyl]oxy}-5-{[(1S)-2-hydroxy-1-methylethyl]oxy}-N-(5-methylpyrazin-2-yl)benzamide
Database identifiers
- PubChem CID
- 11533103
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 114 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 8
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 726
Related reactions
2 records
Compound notes
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