4-(3-Benzyl-5-methyl-2-methylcarbamoyl-benzofuran-7-yl)-piperazine-1-carboxylic acid tert-butyl ester

HCID 59344901
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Basic information

Standard SMILES
CNC(=O)c1oc2c(N3CCN(C(=O)OC(C)(C)C)CC3)cc(C)cc2c1Cc1ccccc1
InChIKey
ZCRPDCGBFVBEHO-UHFFFAOYSA-N
Molecular formula
C27H33N3O4
Average molar mass
463.6 g/mol

Names & identifiers

Preferred name
4-(3-Benzyl-5-methyl-2-methylcarbamoyl-benzofuran-7-yl)-piperazine-1-carboxylic acid tert-butyl ester
IUPAC
tert-butyl 4-[3-benzyl-5-methyl-2-(methylcarbamoyl)-1-benzofuran-7-yl]piperazine-1-carboxylate

Names & synonyms

SCHEMBL3298106ZCRPDCGBFVBEHO-UHFFFAOYSA-N4-(3-Benzyl-5-methyl-2-methylcarbamoyl-benzofuran-7-yl)-piperazine-1-carboxylic acid tert-butyl ester

Database identifiers

PubChem CID
59344901

Properties

Computed structural properties

XLogP
5
Topological polar surface area
75 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
6
Heavy atoms
34

Related reactions

2 records
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Compound notes

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