4-[2-(tert-butoxycarbonylamino)ethoxy]-N-(3-iodophenyl)-3-methoxyphenylacetamide

HCID 22019609
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Basic information

Standard SMILES
COc1cc(CC(=O)Nc2cccc(I)c2)ccc1OCCNC(=O)OC(C)(C)C
InChIKey
MHKHICUDLCDHEB-UHFFFAOYSA-N
Molecular formula
C22H27IN2O5
Average molar mass
526.4 g/mol

Names & identifiers

Preferred name
4-[2-(tert-butoxycarbonylamino)ethoxy]-N-(3-iodophenyl)-3-methoxyphenylacetamide
IUPAC
tert-butyl N-[2-[4-[2-(3-iodoanilino)-2-oxoethyl]-2-methoxyphenoxy]ethyl]carbamate

Names & synonyms

SCHEMBL6101715MHKHICUDLCDHEB-UHFFFAOYSA-N4-[2-(tert-butoxycarbonylamino)ethoxy]-N-(3-iodophenyl)-3-methoxyphenylacetamide

Database identifiers

PubChem CID
22019609

Properties

Computed structural properties

XLogP
4
Topological polar surface area
85.9 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
10
Heavy atoms
30

Related reactions

4 records
New reaction record

Compound notes

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