(2R,4R)-4-Amino-5-(3'-chlorobiphenyl-4-yl)-2-hydroxypentanoic acid 2,2,3,3,3-pentafluoropropyl ester

HCID 86705141
NotesReactions
Substructure searchFind similar structures

Basic information

Standard SMILES
N[C@H](Cc1ccc(-c2cccc(Cl)c2)cc1)C[C@@H](O)C(=O)OCC(F)(F)C(F)(F)F
InChIKey
GIKWTUSZLQVCBQ-IAGOWNOFSA-N
Molecular formula
C20H19ClF5NO3
Average molar mass
451.8 g/mol
Monoisotopic mass
451.097362

Names & identifiers

Preferred name
(2R,4R)-4-Amino-5-(3'-chlorobiphenyl-4-yl)-2-hydroxypentanoic acid 2,2,3,3,3-pentafluoropropyl ester
IUPAC
2,2,3,3,3-pentafluoropropyl (2R,4R)-4-amino-5-[4-(3-chlorophenyl)phenyl]-2-hydroxypentanoate

Names & synonyms

(2R,4R)-4-Amino-5-(3'-chlorobiphenyl-4-yl)-2-hydroxypentanoic acid 2,2,3,3,3-pentafluoropropyl esterSCHEMBL14890643

Database identifiers

PubChem CID
86705141

Properties

Computed structural properties

XLogP
5
Topological polar surface area
72.6 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
9
Rotatable bonds
9
Heavy atoms
30

Related reactions

1 records
New reaction record

Compound notes

Loading…