Piperazine, 1-(3-((1-methylethyl)amino)-2-pyridinyl)-4-((5-methyl-1H-indol-2-yl)carbonyl)-
Basic information
- CAS
136817-43-1- Standard SMILES
Cc1ccc2[nH]c(C(=O)N3CCN(c4ncccc4NC(C)C)CC3)cc2c1- InChIKey
VGHQVWZHPYJOES-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-((5-methyl-1H-indol-2-yl)carbonyl)-
- IUPAC
- (5-methyl-1H-indol-2-yl)-[4-[3-(propan-2-ylamino)-2-pyridinyl]piperazin-1-yl]methanone
Names & synonyms
136817-43-1Piperazine, 1-(3-((1-methylethyl)amino)-2-pyridinyl)-4-((5-methyl-1H-indol-2-yl)carbonyl)-N-(5-Methyl-2-indolcarbonyl)-N'-(3-(isopropylamino)-2-pyridinyl)piperazineN-[5-Methyl-2-indolcarbonyl]-N'-[3-(isopropylamino)-2-pyridinyl]piperazinePiperazine, 1-[3-[(1-methylethyl)amino]-2-pyridinyl]-4-[(5-methyl-1H-indol-2-yl)carbonyl]-BDBM2294CHEMBL287924SCHEMBL18326508DTXSID50159956(5-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]-(5-methyl-1H-indol-2-yl)methanone2-{4-[(5-methyl-1H-indol-2-yl)carbonyl]piperazin-1-yl}-N-(propan-2-yl)pyridin-3-amine
Database identifiers
- CAS
136817-43-1- PubChem CID
- 453386
- DTXSID
DTXSID50159956- ChEMBL
CHEMBL287924
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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Compound notes
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