(2-Bromopyridin-4-yl)(3-methylpiperazin-1-yl)methanone
Basic information
- CAS
909409-93-4- Standard SMILES
CC1CN(C(=O)c2ccnc(Br)c2)CCN1- InChIKey
XYPDUBMTNKQHGB-UHFFFAOYSA-N- Molecular formula
- C11H14BrN3O
- Average molar mass
- 284.15 g/mol
- Monoisotopic mass
- 283.03202
Names & identifiers
- Preferred name
- (2-Bromopyridin-4-yl)(3-methylpiperazin-1-yl)methanone
- IUPAC
- (2-bromo-4-pyridinyl)-(3-methylpiperazin-1-yl)methanone
Names & synonyms
909409-93-4DTXSID20694602(2-Bromopyridin-4-yl)(3-methylpiperazin-1-yl)methanone(R)-2-Methyl-4-(2'-bromopyridinyl) carbonyl piperazine
Database identifiers
- CAS
909409-93-4- PubChem CID
- 53399264
- DTXSID
DTXSID20694602
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 45.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 262
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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