tert-butyl N-[2-[2-methoxy-4-[2-[3-[2-(3-methylphenyl)ethenyl]anilino]-2-oxoethyl]phenoxy]ethyl]carbamate

HCID 69664002
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Basic information

Standard SMILES
COc1cc(CC(=O)Nc2cccc(C=Cc3cccc(C)c3)c2)ccc1OCCNC(=O)OC(C)(C)C
InChIKey
XBGWBMGIHMIFQQ-UHFFFAOYSA-N
Molecular formula
C31H36N2O5
Average molar mass
516.6 g/mol
Monoisotopic mass
516.26242225

Names & identifiers

Preferred name
tert-butyl N-[2-[2-methoxy-4-[2-[3-[2-(3-methylphenyl)ethenyl]anilino]-2-oxoethyl]phenoxy]ethyl]carbamate
IUPAC
tert-butyl N-[2-[2-methoxy-4-[2-[3-[2-(3-methylphenyl)ethenyl]anilino]-2-oxoethyl]phenoxy]ethyl]carbamate

Names & synonyms

SCHEMBL6099791

Database identifiers

PubChem CID
69664002

Properties

Computed structural properties

XLogP
6
Topological polar surface area
85.9 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
12
Heavy atoms
38

Related reactions

1 records
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Compound notes

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