N'-[4-(1H-indol-3-yl)pyrimidin-2-yl]-4-methoxy-6-(4-methylpiperazin-1-yl)benzene-1,3-diamine

HCID 86677249
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Basic information

Standard SMILES
COc1cc(N2CCN(C)CC2)c(N)cc1Nc1nccc(-c2c[nH]c3ccccc23)n1
InChIKey
WQNSERSUUBBXFC-UHFFFAOYSA-N
Molecular formula
C24H27N7O
Average molar mass
429.5 g/mol

Names & identifiers

Preferred name
N'-[4-(1H-indol-3-yl)pyrimidin-2-yl]-4-methoxy-6-(4-methylpiperazin-1-yl)benzene-1,3-diamine
IUPAC
3-N-[4-(1H-indol-3-yl)pyrimidin-2-yl]-4-methoxy-6-(4-methylpiperazin-1-yl)benzene-1,3-diamine

Names & synonyms

SCHEMBL14719022WQNSERSUUBBXFC-UHFFFAOYSA-NN'-[4-(1H-indol-3-yl)pyrimidin-2-yl]-4-methoxy-6-(4-methylpiperazin-1-yl)benzene-1,3-diamine

Database identifiers

PubChem CID
86677249

Properties

Computed structural properties

XLogP
3.1
Topological polar surface area
95.3 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
7
Rotatable bonds
5
Heavy atoms
32

Related reactions

2 records
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Compound notes

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