5-Chloro-alpha-(2,4,6-trimethoxyphenyl)-2-(neopentylamino)benzyl alcohol

HCID 54144775
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Basic information

Standard SMILES
COc1cc(OC)c(C(O)c2cc(Cl)ccc2NCC(C)(C)C)c(OC)c1
InChIKey
ODOVMFPSMBXHSU-UHFFFAOYSA-N
Molecular formula
C21H28ClNO4
Average molar mass
393.9 g/mol

Names & identifiers

Preferred name
5-Chloro-alpha-(2,4,6-trimethoxyphenyl)-2-(neopentylamino)benzyl alcohol
IUPAC
[5-chloro-2-(2,2-dimethylpropylamino)phenyl]-(2,4,6-trimethoxyphenyl)methanol

Names & synonyms

SCHEMBL6961188ODOVMFPSMBXHSU-UHFFFAOYSA-N5-chloro-alpha-(2,4,6-trimethoxyphenyl)-2-(neopentylamino)benzyl alcohol

Database identifiers

PubChem CID
54144775

Properties

Computed structural properties

XLogP
5.5
Topological polar surface area
60 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
8
Heavy atoms
27

Related reactions

2 records
New reaction record

Linked notes

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