(6-Bromopyridin-3-yl)[4-(5-ethyl-3-methylpyridin-2-yl)piperazin-1-yl]methanone
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Basic information
- Standard SMILES
CCc1cnc(N2CCN(C(=O)c3ccc(Br)nc3)CC2)c(C)c1- InChIKey
GGFFOCIOFGIQNJ-UHFFFAOYSA-N- Molecular formula
- C18H21BrN4O
- Average molar mass
- 389.3 g/mol
- Monoisotopic mass
- 388.08987
Names & identifiers
- Preferred name
- (6-Bromopyridin-3-yl)[4-(5-ethyl-3-methylpyridin-2-yl)piperazin-1-yl]methanone
- IUPAC
- (6-bromo-3-pyridinyl)-[4-(5-ethyl-3-methyl-2-pyridinyl)piperazin-1-yl]methanone
Names & synonyms
SCHEMBL2366289GGFFOCIOFGIQNJ-UHFFFAOYSA-N(6-bromopyridin-3-yl) [4-(5-ethyl-3-methylpyridin-2-yl)piperazin-1-yl]methanone(6-bromopyridin-3-yl)[4-(5-ethyl-3-methylpyridin-2-yl)piperazin-1-yl]methanone
Database identifiers
- PubChem CID
- 58484652
Properties
Computed structural propertiesFilling in
- XLogP
- 3.4
- Topological polar surface area
- 49.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 427
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Related reactions
16 records
Compound notes
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