tert-Butyl 4-[(Benzyloxy)methyl]hexahydro-3-oxo-1H-1,4-diazepine-1-carboxylate

HCID 21962085
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Basic information

Standard SMILES
CC(C)(C)OC(=O)N1CCCN(COCc2ccccc2)C(=O)C1
InChIKey
UDRFZAZQZIXALU-UHFFFAOYSA-N
Molecular formula
C18H26N2O4
Average molar mass
334.4 g/mol

Names & identifiers

Preferred name
tert-Butyl 4-[(Benzyloxy)methyl]hexahydro-3-oxo-1H-1,4-diazepine-1-carboxylate
IUPAC
tert-butyl 3-oxo-4-(phenylmethoxymethyl)-1,4-diazepane-1-carboxylate

Names & synonyms

SCHEMBL5037174UDRFZAZQZIXALU-UHFFFAOYSA-Ntert-Butyl 4-[(Benzyloxy)methyl]hexahydro-3-oxo-1H-1,4-diazepine-1-carboxylate

Database identifiers

PubChem CID
21962085

Properties

Computed structural properties

XLogP
2.2
Topological polar surface area
59.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
6
Heavy atoms
24

Related reactions

7 records
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Compound notes

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