2-(3,5-Dichlorophenyl)-1,3-dioxo-hexahydro-imidazo[1,5-a]pyrazine-7-carboxylic Acid Tert-Butyl Ester

HCID 22479202
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Basic information

Standard SMILES
CC(C)(C)OC(=O)N1CCN2C(=O)N(c3cc(Cl)cc(Cl)c3)C(=O)C2C1
InChIKey
QDLDIBGUSWXWTQ-UHFFFAOYSA-N
Molecular formula
C17H19Cl2N3O4
Average molar mass
400.3 g/mol

Names & identifiers

Preferred name
2-(3,5-Dichlorophenyl)-1,3-dioxo-hexahydro-imidazo[1,5-a]pyrazine-7-carboxylic Acid Tert-Butyl Ester
IUPAC
tert-butyl 2-(3,5-dichlorophenyl)-1,3-dioxo-5,6,8,8a-tetrahydroimidazo[1,5-a]pyrazine-7-carboxylate

Names & synonyms

SCHEMBL4848130QDLDIBGUSWXWTQ-UHFFFAOYSA-N2-(3,5-Dichlorophenyl)-1,3-dioxo-hexahydro-imidazo[1,5-a]pyrazine-7-carboxylic Acid Tert-Butyl Ester

Database identifiers

PubChem CID
22479202

Properties

Computed structural properties

XLogP
2.8
Topological polar surface area
70.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
26

Related reactions

2 records
New reaction record

Linked notes

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