Methyl 4-[4'-(formylamino)-1,1'-biphenyl-4-yl]-2,2-dimethyl-4-oxobutanoate

HCID 21985799
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Basic information

Standard SMILES
COC(=O)C(C)(C)CC(=O)c1ccc(-c2ccc(NC=O)cc2)cc1
InChIKey
CAKQINBQFMSFNB-UHFFFAOYSA-N
Molecular formula
C20H21NO4
Average molar mass
339.4 g/mol
Monoisotopic mass
339.14705815

Names & identifiers

Preferred name
Methyl 4-[4'-(formylamino)-1,1'-biphenyl-4-yl]-2,2-dimethyl-4-oxobutanoate
IUPAC
methyl 4-[4-(4-formamidophenyl)phenyl]-2,2-dimethyl-4-oxobutanoate

Names & synonyms

SCHEMBL1748176CAKQINBQFMSFNB-UHFFFAOYSA-Nmethyl 4-[4'-(formylamino)-1,1'-biphenyl-4-yl]-2,2-dimethyl-4-oxobutanoate

Database identifiers

PubChem CID
21985799

Properties

Computed structural properties

XLogP
3.1
Topological polar surface area
72.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
7
Heavy atoms
25

Related reactions

9 records
New reaction record

Linked notes

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