3,4-Dihydro-3beta-phenyl-2H-1,4-benzooxazine
Basic information
- Standard SMILES
c1ccc([C@@H]2COc3ccccc3N2)cc1- InChIKey
BKQRBYFLQYHTCV-ZDUSSCGKSA-N- Molecular formula
- C14H13NO
- Average molar mass
- 211.26 g/mol
Names & identifiers
- Preferred name
- 3,4-Dihydro-3beta-phenyl-2H-1,4-benzooxazine
- IUPAC
- (3R)-3-phenyl-3,4-dihydro-2H-1,4-benzoxazine
Names & synonyms
3,4-Dihydro-3beta-phenyl-2H-1,4-benzooxazine(3r)-3-phenyl-3,4-dihydro-2h-1,4-benzoxazineSCHEMBL6436184CHEMBL5021292BKQRBYFLQYHTCV-ZDUSSCGKSA-N(R)-3-PHENYL-3,4-DIHYDRO-2H-BENZO[B][1,4]OXAZINE324817-53-0F91999(R)-3,4-dihydro-3-phenyl-2H-1,4-benzoxazineZ5023070093
Database identifiers
- PubChem CID
- 69780407
- ChEMBL
CHEMBL5021292- Nikkaji
- J2.378.960D
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 21.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 225
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Related reactions
1 records
Compound notes
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