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Piperazine, 1-(3-((1-methylethyl)amino)-2-pyridinyl)-4-((3-methyl-1H-indol-2-yl)carbonyl)-

HCID 453382
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Basic information

CAS
136817-30-6
Standard SMILES
Cc1c(C(=O)N2CCN(c3ncccc3NC(C)C)CC2)[nH]c2ccccc12
InChIKey
QQFPIFOITOLHFJ-UHFFFAOYSA-N
Molecular formula
C22H27N5O
Average molar mass
377.5 g/mol
Monoisotopic mass
377.2215605

Names & identifiers

Preferred name
Piperazine, 1-(3-((1-methylethyl)amino)-2-pyridinyl)-4-((3-methyl-1H-indol-2-yl)carbonyl)-
IUPAC
(3-methyl-1H-indol-2-yl)-[4-[3-(propan-2-ylamino)-2-pyridinyl]piperazin-1-yl]methanone

Names & synonyms

136817-30-6Piperazine, 1-(3-((1-methylethyl)amino)-2-pyridinyl)-4-((3-methyl-1H-indol-2-yl)carbonyl)-N-((3-Methyl-2-indol)carbonyl)-N'-((3-isopropylamino)-2-pyridinyl)piperazineN-[(3-Methyl-2-indol)carbonyl]-N'-[(3-isopropylamino)-2-pyridinyl]piperazinePiperazine, 1-[3-[(1-methylethyl)amino]-2-pyridinyl]-4-[(3-methyl-1H-indol-2-yl)carbonyl]-DTXSID30159954(3-Methyl-1H-indol-2-yl)(4-{3-[(propan-2-yl)amino]pyridin-2-yl}piperazin-1-yl)methanone[4-[3-(isopropylamino)-2-pyridyl]piperazin-1-yl]-(3-methyl-1H-indol-2-yl)methanone

Database identifiers

CAS
136817-30-6
PubChem CID
453382
DTXSID
DTXSID30159954

Properties

Computed structural properties

XLogP
3.8
Topological polar surface area
64.3 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
28
Formal charge
0
Complexity
533

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