(3aRS,7aRS)-2-[(2-dimethylamino-6-fluorophenyl)acetyl]-7,7-diphenyl-4-perhydroisoindolone

HCID 67916077
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Basic information

Standard SMILES
CN(C)c1cccc(F)c1CC(=O)N1CC2C(=O)CCC(c3ccccc3)(c3ccccc3)C2C1
InChIKey
RYVNNQSOOJDPNP-UHFFFAOYSA-N
Molecular formula
C30H31FN2O2
Average molar mass
470.6 g/mol

Names & identifiers

Preferred name
(3aRS,7aRS)-2-[(2-dimethylamino-6-fluorophenyl)acetyl]-7,7-diphenyl-4-perhydroisoindolone
IUPAC
2-[2-[2-(dimethylamino)-6-fluorophenyl]acetyl]-7,7-diphenyl-1,3,3a,5,6,7a-hexahydroisoindol-4-one

Names & synonyms

SCHEMBL9730357RYVNNQSOOJDPNP-UHFFFAOYSA-N(3aRS,7aRS)-2-[(2-dimethylamino-6-fluorophenyl)acetyl]-7,7-diphenyl-4-perhydroisoindolone

Database identifiers

PubChem CID
67916077

Properties

Computed structural properties

XLogP
4.8
Topological polar surface area
40.6 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
5
Heavy atoms
35

Related reactions

2 records
New reaction record

Compound notes

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(3aRS,7aRS)-2-[(2-dimethylamino-6-fluorophenyl)acetyl]-7,7-diphenyl-4-perhydroisoindolone (HCID 67916077)｜Huagongshe