1-(4-Methylsulfonylphenyl)-4-[1-(5-phenylpyrimidin-2-yl)piperidin-4-yl]oxy-2,3-dihydroindole

HCID 58017014
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Basic information

Standard SMILES
CS(=O)(=O)c1ccc(N2CCc3c(OC4CCN(c5ncc(-c6ccccc6)cn5)CC4)cccc32)cc1
InChIKey
VZLAKSAZFUSGND-UHFFFAOYSA-N
Molecular formula
C30H30N4O3S
Average molar mass
526.7 g/mol
Monoisotopic mass
526.20386201

Names & identifiers

Preferred name
1-(4-Methylsulfonylphenyl)-4-[1-(5-phenylpyrimidin-2-yl)piperidin-4-yl]oxy-2,3-dihydroindole
IUPAC
1-(4-methylsulfonylphenyl)-4-[1-(5-phenylpyrimidin-2-yl)piperidin-4-yl]oxy-2,3-dihydroindole

Names & synonyms

SCHEMBL4010950

Database identifiers

PubChem CID
58017014

Properties

Computed structural properties

XLogP
5.5
Topological polar surface area
84 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
7
Rotatable bonds
6
Heavy atoms
38

Related reactions

1 records
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Compound notes

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