7-Phenyl-6,7-dihydro-5H-[1,2,4]triazolo[5,1-b][1,3]oxazin-2-ylamine
Basic information
- Standard SMILES
Nc1nc2n(n1)C(c1ccccc1)CCO2- InChIKey
RAECEFGQLGZISL-UHFFFAOYSA-N- Molecular formula
- C11H12N4O
- Average molar mass
- 216.24 g/mol
- Monoisotopic mass
- 216.10111102
Names & identifiers
- Preferred name
- 7-Phenyl-6,7-dihydro-5H-[1,2,4]triazolo[5,1-b][1,3]oxazin-2-ylamine
- IUPAC
- 7-phenyl-6,7-dihydro-5H-[1,2,4]triazolo[5,1-b][1,3]oxazin-2-amine
Names & synonyms
SCHEMBL2254580RAECEFGQLGZISL-UHFFFAOYSA-N1319068-66-0DB-3830716,7-Dihydro-7-phenyl-5H-[1,2,4]triazolo[5,1-b][1,3]oxazin-2-amine7-phenyl-6,7-dihydro-5H-[1,2,4]triazolo[5,1-b][1,3]oxazin-2-amine7-Phenyl-6,7-dihydro-5H-[1,2,4]triazolo[5,1-b][1,3]oxazin-2-ylamine
Database identifiers
- PubChem CID
- 67336166
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 66 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 244
Related reactions
4 records
Compound notes
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