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[4-(1-tert-butoxycarbonylmethyl-2,4-dioxo-1,4-dihydro-2H-quinazolin-3-yl)-phenyl]-acetic acid ethyl ester

HCID 68589591
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CCOC(=O)Cc1ccc(-n2c(=O)c3ccccc3n(CC(=O)OC(C)(C)C)c2=O)cc1
InChIKey
ZFHYTFWWVOZIML-UHFFFAOYSA-N
Molecular formula
C24H26N2O6
Average molar mass
438.5 g/mol

Names & identifiers

Preferred name
[4-(1-tert-butoxycarbonylmethyl-2,4-dioxo-1,4-dihydro-2H-quinazolin-3-yl)-phenyl]-acetic acid ethyl ester
IUPAC
ethyl 2-[4-[1-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-2,4-dioxoquinazolin-3-yl]phenyl]acetate

Names & synonyms

SCHEMBL3306322ZFHYTFWWVOZIML-UHFFFAOYSA-N[4-(1-tert-butoxycarbonylmethyl-2,4-dioxo-1,4-dihydro-2H-quinazolin-3-yl)-phenyl]-acetic acid ethyl ester

Database identifiers

PubChem CID
68589591

Properties

Computed structural properties

XLogP
3.4
Topological polar surface area
93.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
9
Heavy atoms
32
Formal charge
0
Complexity
722

Related reactions

2 records
New reaction record
HRID 472747 reaction equation
HRID 472747As reactantuspto-grants-2014_01
HRID 472748 reaction equation
HRID 472748As productuspto-grants-2014_01

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes