N-(5-((2S,5R,6S)-5-amino-6-fluorooxepan-2-yl)-1-methyl-1H-pyrazol-4-yl)-6-(2,6-difluoro-4-(1-hydroxycyclobutyl)phenyl)-5-fluoropicolinamide

HCID 73438136
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Basic information

Standard SMILES
Cn1ncc(NC(=O)c2ccc(F)c(-c3c(F)cc(C4(O)CCC4)cc3F)n2)c1[C@@H]1CC[C@@H](N)[C@H](F)CO1
InChIKey
YWCTXPLQZXBEPO-OPYAIIAOSA-N
Molecular formula
C26H27F4N5O3
Average molar mass
533.5 g/mol

Names & identifiers

Preferred name
N-(5-((2S,5R,6S)-5-amino-6-fluorooxepan-2-yl)-1-methyl-1H-pyrazol-4-yl)-6-(2,6-difluoro-4-(1-hydroxycyclobutyl)phenyl)-5-fluoropicolinamide
IUPAC
N-[5-[(2S,5R,6S)-5-amino-6-fluorooxepan-2-yl]-1-methylpyrazol-4-yl]-6-[2,6-difluoro-4-(1-hydroxycyclobutyl)phenyl]-5-fluoropyridine-2-carboxamide

Names & synonyms

CHEMBL4109184SCHEMBL15609531YWCTXPLQZXBEPO-OPYAIIAOSA-NBDBM227247US9328106, 198N-(5-((2S,5R,6S)-5-amino-6-fluorooxepan-2-yl)-1-methyl-1H-pyrazol-4-yl)-6-(2,6-difluoro-4-(1-hydroxycyclobutyl)phenyl)-5-fluoropicolinamide

Database identifiers

PubChem CID
73438136
ChEMBL
CHEMBL4109184

Properties

Computed structural properties

XLogP
1.9
Topological polar surface area
115 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
10
Rotatable bonds
5
Heavy atoms
38

Related reactions

1 records
New reaction record

Compound notes

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