isopropyl 2-(3-(6-Hexyl-1-naphthamido)phenoxy)acetate

HCID 66660445
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Basic information

Standard SMILES
CCCCCCc1ccc2c(C(=O)Nc3cccc(OCC(=O)OC(C)C)c3)cccc2c1
InChIKey
CPVBJAGLMMIERM-UHFFFAOYSA-N
Molecular formula
C28H33NO4
Average molar mass
447.6 g/mol

Names & identifiers

Preferred name
isopropyl 2-(3-(6-Hexyl-1-naphthamido)phenoxy)acetate
IUPAC
propan-2-yl 2-[3-[(6-hexylnaphthalene-1-carbonyl)amino]phenoxy]acetate

Names & synonyms

SCHEMBL343323CPVBJAGLMMIERM-UHFFFAOYSA-Nisopropyl 2-(3-(6-Hexyl-1-naphthamido)phenoxy)acetate

Database identifiers

PubChem CID
66660445

Properties

Computed structural properties

XLogP
7.7
Topological polar surface area
64.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
12
Heavy atoms
33

Related reactions

2 records
New reaction record

Compound notes

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