Piperazine, 1-(1H-indol-2-ylcarbonyl)-4-(3-((phenylmethyl)amino)-2-pyridinyl)-
Basic information
- CAS
153473-56-4- Standard SMILES
O=C(c1cc2ccccc2[nH]1)N1CCN(c2ncccc2NCc2ccccc2)CC1- InChIKey
LJRNOCGYBNRDSO-UHFFFAOYSA-N- Molecular formula
- C25H25N5O
- Average molar mass
- 411.5 g/mol
- Monoisotopic mass
- 411.20591044
Names & identifiers
- Preferred name
- Piperazine, 1-(1H-indol-2-ylcarbonyl)-4-(3-((phenylmethyl)amino)-2-pyridinyl)-
- IUPAC
- [4-[3-(benzylamino)-2-pyridinyl]piperazin-1-yl]-(1H-indol-2-yl)methanone
Names & synonyms
153473-56-4Piperazine, 1-(1H-indol-2-ylcarbonyl)-4-(3-((phenylmethyl)amino)-2-pyridinyl)-1-(Indolyl-2-carbonyl)-4-((3-benzylamino)-2-pyridyl)piperazineDTXSID101653361-(Indolyl-2-carbonyl)-4-[(3-benzylamino)-2-pyridyl]piperazinePiperazine, 1-(1H-indol-2-ylcarbonyl)-4-[3-[(phenylmethyl)amino]-2-pyridinyl]-RefChem:371932DTXCID9087827CHEMBL6493[4-[3-(benzylamino)-2-pyridyl]piperazin-1-yl]-(1H-indol-2-yl)methanone{4-[3-(Benzylamino)pyridin-2-yl]piperazin-1-yl}(1H-indol-2-yl)methanone
Database identifiers
- CAS
153473-56-4- PubChem CID
- 453398
- DTXSID
DTXSID10165336- ChEMBL
CHEMBL6493
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 64.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 586
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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