4-(2,3-Dihydro-1H-indol-1-yl)-1-(3,4-dimethoxybenzoyl)-2-methyl-1,2,3,4-tetrahydroquinoline

HCID 22339337
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Basic information

Standard SMILES
COc1ccc(C(=O)N2c3ccccc3C(N3CCc4ccccc43)CC2C)cc1OC
InChIKey
WQXUWMDAZJJHDV-UHFFFAOYSA-N
Molecular formula
C27H28N2O3
Average molar mass
428.5 g/mol
Monoisotopic mass
428.20999276

Names & identifiers

Preferred name
4-(2,3-Dihydro-1H-indol-1-yl)-1-(3,4-dimethoxybenzoyl)-2-methyl-1,2,3,4-tetrahydroquinoline
IUPAC
[4-(2,3-dihydroindol-1-yl)-2-methyl-3,4-dihydro-2H-quinolin-1-yl]-(3,4-dimethoxyphenyl)methanone

Names & synonyms

SCHEMBL6419430WQXUWMDAZJJHDV-UHFFFAOYSA-N4-(2,3-Dihydro-1H-indol-1-yl)-1-(3,4-dimethoxybenzoyl)-2-methyl-1,2,3,4-tetrahydroquinoline

Database identifiers

PubChem CID
22339337

Properties

Computed structural properties

XLogP
5.1
Topological polar surface area
42 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
32

Related reactions

2 records
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Compound notes

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