3-Amino-4-(3,5-difluoro-phenyl)-1-[1-(3-ethyl-phenyl)-cyclopropylamino]-butan-2-ol

HCID 21085482
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Basic information

Standard SMILES
CCc1cccc(C2(NCC(O)C(N)Cc3cc(F)cc(F)c3)CC2)c1
InChIKey
WROBFEBFPSXVRV-UHFFFAOYSA-N
Molecular formula
C21H26F2N2O
Average molar mass
360.4 g/mol

Names & identifiers

Preferred name
3-Amino-4-(3,5-difluoro-phenyl)-1-[1-(3-ethyl-phenyl)-cyclopropylamino]-butan-2-ol
IUPAC
3-amino-4-(3,5-difluorophenyl)-1-[[1-(3-ethylphenyl)cyclopropyl]amino]butan-2-ol

Names & synonyms

SCHEMBL2867154WROBFEBFPSXVRV-UHFFFAOYSA-N3-Amino-4-(3,5-difluoro-phenyl)-1-[1-(3-ethyl-phenyl)-cyclopropylamino]-butan-2-ol

Database identifiers

PubChem CID
21085482

Properties

Computed structural properties

XLogP
3.6
Topological polar surface area
58.3 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
5
Rotatable bonds
8
Heavy atoms
26

Related reactions

6 records
New reaction record

Compound notes

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