N'-((2R,3R)-2-(3-chloro-4-cyano-2-methylphenylamino)-3-hydroxybutanoyl)-4-fluorobenzohydrazide

HCID 67006145
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Basic information

Standard SMILES
Cc1c(N[C@@H](C(=O)NNC(=O)c2ccc(F)cc2)[C@@H](C)O)ccc(C#N)c1Cl
InChIKey
FYMZXWWVRMCRLV-PIGZYNQJSA-N
Molecular formula
C19H18ClFN4O3
Average molar mass
404.8 g/mol
Monoisotopic mass
404.1051463

Names & identifiers

Preferred name
N'-((2R,3R)-2-(3-chloro-4-cyano-2-methylphenylamino)-3-hydroxybutanoyl)-4-fluorobenzohydrazide
IUPAC
N'-[(2R,3R)-2-(3-chloro-4-cyano-2-methylanilino)-3-hydroxybutanoyl]-4-fluorobenzohydrazide

Names & synonyms

SCHEMBL1363641FYMZXWWVRMCRLV-PIGZYNQJSA-NN'-((2R,3R)-2-(3-chloro-4-cyano-2-methylphenylamino)-3-hydroxybutanoyl)-4-fluorobenzohydrazide

Database identifiers

PubChem CID
67006145

Properties

Computed structural properties

XLogP
3.6
Topological polar surface area
114 Ų
Hydrogen bond donors
4
Hydrogen bond acceptors
6
Rotatable bonds
5
Heavy atoms
28

Related reactions

4 records
New reaction record

Compound notes

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