methyl 5-amino-4-[7-[(1,5-dimethylpyrazol-3-yl)methoxy]-3-oxo-1H-isoindol-2-yl]-5-oxopentanoate

HCID 67334984
Substructure searchFind similar structures

Basic information

Standard SMILES
COC(=O)CCC(C(N)=O)N1Cc2c(OCc3cc(C)n(C)n3)cccc2C1=O
InChIKey
FJTHAEPAHOBODT-UHFFFAOYSA-N
Molecular formula
C20H24N4O5
Average molar mass
400.4 g/mol

Names & identifiers

Preferred name
methyl 5-amino-4-[7-[(1,5-dimethylpyrazol-3-yl)methoxy]-3-oxo-1H-isoindol-2-yl]-5-oxopentanoate
IUPAC
methyl 5-amino-4-[7-[(1,5-dimethylpyrazol-3-yl)methoxy]-3-oxo-1H-isoindol-2-yl]-5-oxopentanoate

Names & synonyms

SCHEMBL2251690

Database identifiers

PubChem CID
67334984

Properties

Computed structural properties

XLogP
0.3
Topological polar surface area
117 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
9
Heavy atoms
29

Related reactions

2 records
New reaction record

Linked notes

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