2-(5-Bromopyridin-3-yl)-1,3-benzoxazol-5-amine
Basic information
- CAS
696632-95-8- Standard SMILES
Nc1ccc2oc(-c3cncc(Br)c3)nc2c1- InChIKey
SGYSMLIWRDOTOT-UHFFFAOYSA-N- Molecular formula
- C12H8BrN3O
- Average molar mass
- 290.11 g/mol
- Monoisotopic mass
- 288.98507
Names & identifiers
- Preferred name
- 2-(5-Bromopyridin-3-yl)-1,3-benzoxazol-5-amine
- IUPAC
- 2-(5-bromo-3-pyridinyl)-1,3-benzoxazol-5-amine
- English name
- 2-(5-BROMO-PYRIDIN-3-YL)-BENZOOXAZOL-5-YLAMINE
- Molecular formula
- C12H8BrN3O
- Molecular weight
- 290.12
Names & synonyms
696632-95-82-(5-bromopyridin-3-yl)-1,3-benzoxazol-5-amineDTXSID80339441RefChem:252895DTXCID202905222-(5-bromopyridin-3-yl)benzo[d]oxazol-5-amine5-Amino-2-(5-bromo-3-pyridyl)benzoxazoleSGYSMLIWRDOTOT-UHFFFAOYSA-NSTK279509AKOS000108570ST41018102-(5-bromo-3-pyridyl)benzoxazole-5-ylamine
Show more names
AKOS BB-8048ASISCHEM Y97459UKRORGSYN-BB BBV-2016112-(5-BROMO-3-PYRIDINYL)-5-BENZOXAZOLAMINE5-BENZOXAZOLAMINE, 2-(5-BROMO-3-PYRIDINYL)-2-(5-BROMO-PYRIDIN-3-YL)-BENZOOXAZOL-5-YLAMINE
CS-03195482-(5-Bromo-3-pyridinyl)-1,3-benzoxazol-5-amine #
Database identifiers
- CAS
696632-95-8- PubChem CID
- 556243
- DTXSID
DTXSID80339441
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 64.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 278
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Compound notes
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