2-[4-tert-Butyl-2-(piperidine-1-ylmethyl)phenoxy]-N-((1R)-1-{3-methyl-4-[(methylsulfonyl)amino]phenyl}ethyl)acetamide

HCID 11706236
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Basic information

Standard SMILES
Cc1cc([C@@H](C)NC(=O)COc2ccc(C(C)(C)C)cc2CN2CCCCC2)ccc1NS(C)(=O)=O
InChIKey
QAUQKGJGTQYLDH-OAQYLSRUSA-N
Molecular formula
C28H41N3O4S
Average molar mass
515.7 g/mol
Monoisotopic mass
515.28177797

Names & identifiers

Preferred name
2-[4-tert-Butyl-2-(piperidine-1-ylmethyl)phenoxy]-N-((1R)-1-{3-methyl-4-[(methylsulfonyl)amino]phenyl}ethyl)acetamide
IUPAC
2-[4-tert-butyl-2-(piperidin-1-ylmethyl)phenoxy]-N-[(1R)-1-[4-(methanesulfonamido)-3-methylphenyl]ethyl]acetamide

Names & synonyms

SCHEMBL4640498QAUQKGJGTQYLDH-OAQYLSRUSA-N2-[4-tert-Butyl-2-(piperidine-1-ylmethyl)phenoxy]-N-((1R)-1-{3-methyl-4-[(methylsulfonyl)amino]phenyl}ethyl)acetamide

Database identifiers

PubChem CID
11706236

Properties

Computed structural properties

XLogP
4.8
Topological polar surface area
96.1 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
10
Heavy atoms
36

Related reactions

1 records
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Compound notes

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