11-(2-Hexyl-5-hydroxyphenoxy)-N-(4-hydroxyphenyl)undecanamide

HCID 11626933

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Basic information

CAS: 869376-91-0
Standard SMILES: CCCCCCc1ccc(O)cc1OCCCCCCCCCCC(=O)Nc1ccc(O)cc1
InChIKey: SBZUBYZOOZUSIW-UHFFFAOYSA-N
Molecular formula: C29H43NO4
Average molar mass: 469.7 g/mol
Monoisotopic mass: 469.31920885

Names & identifiers

Preferred name: 11-(2-Hexyl-5-hydroxyphenoxy)-N-(4-hydroxyphenyl)undecanamide
IUPAC: 11-(2-hexyl-5-hydroxyphenoxy)-N-(4-hydroxyphenyl)undecanamide

Names & synonyms

CHEMBL223223DTXSID30118331911-(2-Hexyl-5-hydroxyphenoxy)-N-(4-hydroxyphenyl)undecanamideBDBM50176961869376-91-011-(2-hexyl-5-hydroxyphenoxy)undecanoic acid (4-hydroxyphenyl)amide

Database identifiers

CAS: 869376-91-0
PubChem CID: 11626933
DTXSID: DTXSID301183319
ChEMBL: CHEMBL223223

Properties

Computed structural properties

XLogP: 8.7
Topological polar surface area: 78.8 Å²
Hydrogen bond donors: 3
Hydrogen bond acceptors: 4
Rotatable bonds: 18
Heavy atoms: 34
Formal charge: 0
Complexity: 506

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