cis-2-[3-(1h-Indazol-5-yloxy)cyclohexyl]-1h-isoindole-1,3(2h)-dione

HCID 69433889
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Basic information

Standard SMILES
O=C1c2ccccc2C(=O)N1[C@H]1CCC[C@@H](Oc2ccc3[nH]ncc3c2)C1
InChIKey
PUFDTYGMNJAHHK-LSDHHAIUSA-N
Molecular formula
C21H19N3O3
Average molar mass
361.4 g/mol

Names & identifiers

Preferred name
cis-2-[3-(1h-Indazol-5-yloxy)cyclohexyl]-1h-isoindole-1,3(2h)-dione
IUPAC
2-[(1S,3R)-3-(1H-indazol-5-yloxy)cyclohexyl]isoindole-1,3-dione

Names & synonyms

SCHEMBL5417570PUFDTYGMNJAHHK-LSDHHAIUSA-Ncis-2-[3-(1h-indazol-5-yloxy)cyclohexyl]-1h-isoindole-1,3(2h)-dione

Database identifiers

PubChem CID
69433889

Properties

Computed structural properties

XLogP
3.5
Topological polar surface area
75.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
27

Related reactions

1 records
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Compound notes

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