N-(5-((1R,2S)-2-(3,5-Bis(trifluoromethyl)benzylamino)-1-hydroxypropyl)-2-hydroxyphenyl)methanesulfonamide

HCID 44628482
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Basic information

Standard SMILES
C[C@H](NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)[C@H](O)c1ccc(O)c(NS(C)(=O)=O)c1
InChIKey
KRKAUGQQLSUFMI-BTDLBPIBSA-N
Molecular formula
C19H20F6N2O4S
Average molar mass
486.4 g/mol

Names & identifiers

Preferred name
N-(5-((1R,2S)-2-(3,5-Bis(trifluoromethyl)benzylamino)-1-hydroxypropyl)-2-hydroxyphenyl)methanesulfonamide
IUPAC
N-[5-[(1R,2S)-2-[[3,5-bis(trifluoromethyl)phenyl]methylamino]-1-hydroxypropyl]-2-hydroxyphenyl]methanesulfonamide

Names & synonyms

N-(5-((1R,2S)-2-(3,5-Bis(trifluoromethyl)benzylamino)-1-hydroxypropyl)-2-hydroxyphenyl)methanesulfonamideSCHEMBL1577185

Database identifiers

PubChem CID
44628482

Properties

Computed structural properties

XLogP
2.9
Topological polar surface area
107 Ų
Hydrogen bond donors
4
Hydrogen bond acceptors
12
Rotatable bonds
7
Heavy atoms
32

Related reactions

2 records
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Compound notes

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