3-(Furan-2-yl)-5-(morpholin-4-yl)-6-phenyl-1,2,4-triazine
Basic information
- CAS
6116-01-4- Standard SMILES
c1ccc(-c2nnc(-c3ccco3)nc2N2CCOCC2)cc1- InChIKey
XNSLYPKTTMXCFF-UHFFFAOYSA-N- Molecular formula
- C17H16N4O2
- Average molar mass
- 308.33 g/mol
- Monoisotopic mass
- 308.12732577
Names & identifiers
- Preferred name
- 3-(Furan-2-yl)-5-(morpholin-4-yl)-6-phenyl-1,2,4-triazine
- IUPAC
- 4-[3-(furan-2-yl)-6-phenyl-1,2,4-triazin-5-yl]morpholine
Names & synonyms
6116-01-4Oprea1_469628DTXSID10423327AG-227/373940083-(2-furyl)-5-(4-morpholinyl)-6-phenyl-1,2,4-triazine3-(Furan-2-yl)-5-(morpholin-4-yl)-6-phenyl-1,2,4-triazine
Database identifiers
- CAS
6116-01-4- PubChem CID
- 6404876
- DTXSID
DTXSID10423327
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 64.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 372
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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