(S)-2-Ethanesulfonylamino-N-(2-{4-[2-(4-fluoro-phenoxy)-ethoxy]-3-methoxy-phenyl}-ethyl)-3-methyl-butyramide

HCID 54522274
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Basic information

Standard SMILES
CCS(=O)(=O)N[C@H](C(=O)NCCc1ccc(OCCOc2ccc(F)cc2)c(OC)c1)C(C)C
InChIKey
YQQJSYBCSRJAOM-QHCPKHFHSA-N
Molecular formula
C24H33FN2O6S
Average molar mass
496.6 g/mol
Monoisotopic mass
496.20433611

Names & identifiers

Preferred name
(S)-2-Ethanesulfonylamino-N-(2-{4-[2-(4-fluoro-phenoxy)-ethoxy]-3-methoxy-phenyl}-ethyl)-3-methyl-butyramide
IUPAC
(2S)-2-(ethylsulfonylamino)-N-[2-[4-[2-(4-fluorophenoxy)ethoxy]-3-methoxyphenyl]ethyl]-3-methylbutanamide

Names & synonyms

SCHEMBL6554951YQQJSYBCSRJAOM-QHCPKHFHSA-N(S)-2-Ethanesulfonylamino-N-(2-{4-[2-(4-fluoro-phenoxy)-ethoxy]-3-methoxy-phenyl}-ethyl)-3-methyl-butyramide

Database identifiers

PubChem CID
54522274

Properties

Computed structural properties

XLogP
4.1
Topological polar surface area
111 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
8
Rotatable bonds
14
Heavy atoms
34

Related reactions

1 records
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Compound notes

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