N-(2-bromophenyl)-2-[4-(pyridin-2-yl)piperazin-1-yl]acetamide
Basic information
- CAS
848247-99-4- Standard SMILES
O=C(CN1CCN(c2ccccn2)CC1)Nc1ccccc1Br- InChIKey
KWJOJWBRBSATIB-UHFFFAOYSA-N- Molecular formula
- C17H19BrN4O
- Average molar mass
- 375.3 g/mol
- Monoisotopic mass
- 374.07422
Names & identifiers
- Preferred name
- N-(2-bromophenyl)-2-[4-(pyridin-2-yl)piperazin-1-yl]acetamide
- IUPAC
- N-(2-bromophenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)acetamide
- English name
- N-(2-Bromophenyl)-2-[4-(2-pyridinyl)piperazino]acetamide
- Molecular formula
- C17H19BrN4O
- Molecular weight
- 375.26
Names & synonyms
848247-99-4N-(2-bromophenyl)-2-[4-(pyridin-2-yl)piperazin-1-yl]acetamiden-(2-Bromophenyl)-2-(4-(pyridin-2-yl)piperazin-1-yl)acetamideN-(2-bromophenyl)-2-(4-pyridin-2-ylpiperazin-1-yl)acetamideMLS001165753CHEMBL1721675N-(2-bromophenyl)-2-[4-(2-pyridinyl)piperazino]acetamideHMS2876D11AKOS001102555JS-2046SMR000550451CS-0294356
Show more names
SALOR-INT L157317-1EA1-Piperazineacetamide, N-(2-bromophenyl)-4-(2-pyridinyl)-
Z30996469N-(2-BROMOPHENYL)-2-(4-(2-PYRIDINYL)-1-PIPERAZINYL)ACETAMIDE
Database identifiers
- CAS
848247-99-4- PubChem CID
- 4207409
- ChEMBL
CHEMBL1721675- EC Number
- 123-262-9
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 48.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 387
Physicochemical properties
- Boiling point
- 560.3 · 560.3±50.0 °C(Predicted)
- Density
- 1.439 · 1.439±0.06 g/cm3(Predicted)
- pka
- 13.68 · 13.68±0.70(Predicted)
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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