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5-(2,4-dichlorophenyl)-3,6-diethyl-N-(2-propoxy-2,3-dihydro-1H-inden-1-yl)pyrazin-2-amine

HCID 22147377
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
CCCOC1Cc2ccccc2C1Nc1nc(CC)c(-c2ccc(Cl)cc2Cl)nc1CC
InChIKey
MTAXRQIWNQDTGY-UHFFFAOYSA-N
Molecular formula
C26H29Cl2N3O
Average molar mass
470.4 g/mol

Names & identifiers

Preferred name
5-(2,4-dichlorophenyl)-3,6-diethyl-N-(2-propoxy-2,3-dihydro-1H-inden-1-yl)pyrazin-2-amine
IUPAC
5-(2,4-dichlorophenyl)-3,6-diethyl-N-(2-propoxy-2,3-dihydro-1H-inden-1-yl)pyrazin-2-amine

Database identifiers

PubChem CID
22147377

Properties

Computed structural properties

XLogP
7.1
Topological polar surface area
47 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
8
Heavy atoms
32
Formal charge
0
Complexity
581

Related reactions

1 records
New reaction record
HRID 105531 reaction equation
HRID 105531As productTraining data from https://doi.org/10.1039/C8SC04228D (2/10)

Compound notes

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