(S)-1-(4-Benzyloxyphenoxy)-3-[N-2-(4-hydroxyphenyl)ethylamino]propan-2-ol

HCID 9908577
Substructure searchFind similar structures

Basic information

Standard SMILES
Oc1ccc(CCNC[C@H](O)COc2ccc(OCc3ccccc3)cc2)cc1
InChIKey
ASXXVEOSRKTBMI-QFIPXVFZSA-N
Molecular formula
C24H27NO4
Average molar mass
393.5 g/mol

Names & identifiers

Preferred name
(S)-1-(4-Benzyloxyphenoxy)-3-[N-2-(4-hydroxyphenyl)ethylamino]propan-2-ol
IUPAC
4-[2-[[(2S)-2-hydroxy-3-(4-phenylmethoxyphenoxy)propyl]amino]ethyl]phenol

Names & synonyms

SCHEMBL7558367ASXXVEOSRKTBMI-QFIPXVFZSA-N(S)-1-(4-Benzyloxyphenoxy)-3-[N-2-(4-hydroxyphenyl)ethylamino]propan-2-ol

Database identifiers

PubChem CID
9908577

Properties

Computed structural properties

XLogP
3.9
Topological polar surface area
71 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
5
Rotatable bonds
11
Heavy atoms
29

Related reactions

2 records
New reaction record

Linked notes

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(S)-1-(4-Benzyloxyphenoxy)-3-[N-2-(4-hydroxyphenyl)ethylamino]propan-2-ol (HCID 9908577)｜Huagongshe