Piperazine, 1-((6-methoxy-1H-indol-2-yl)carbonyl)-4-(3-((1-methylethyl)amino)-2-pyridinyl)-
Basic information
- CAS
136817-42-0- Standard SMILES
COc1ccc2cc(C(=O)N3CCN(c4ncccc4NC(C)C)CC3)[nH]c2c1- InChIKey
KNZJWJRPUPRXNG-UHFFFAOYSA-N- Molecular formula
- C22H27N5O2
- Average molar mass
- 393.5 g/mol
- Monoisotopic mass
- 393.21647512
Names & identifiers
- Preferred name
- Piperazine, 1-((6-methoxy-1H-indol-2-yl)carbonyl)-4-(3-((1-methylethyl)amino)-2-pyridinyl)-
- IUPAC
- (6-methoxy-1H-indol-2-yl)-[4-[3-(propan-2-ylamino)-2-pyridinyl]piperazin-1-yl]methanone
Names & synonyms
136817-42-0Piperazine, 1-((6-methoxy-1H-indol-2-yl)carbonyl)-4-(3-((1-methylethyl)amino)-2-pyridinyl)-N-(6-Methoxy-2-indolcarbonyl)-N'-(3-(isopropylamino)-2-pyridinyl)piperazineN-[6-Methoxy-2-indolcarbonyl]-N'-[3-(isopropylamino)-2-pyridinyl]piperazinePiperazine, 1-[(6-methoxy-1H-indol-2-yl)carbonyl]-4-[3-[(1-methylethyl)amino]-2-pyridinyl]-BDBM2296CHEMBL289304DTXSID90159955(6-Methoxy-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]-(6-methoxy-1H-indol-2-yl)methanone2-{4-[(6-methoxy-1H-indol-2-yl)carbonyl]piperazin-1-yl}-N-(propan-2-yl)pyridin-3-amine
Database identifiers
- CAS
136817-42-0- PubChem CID
- 453390
- DTXSID
DTXSID90159955- ChEMBL
CHEMBL289304
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 73.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 551
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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