3,3'-(Propane-1,3-diyl)bis(5-methyl[1,2,4]triazolo[4,3-a]pyridine)
Basic information
- CAS
64762-60-3- Standard SMILES
Cc1cccc2nnc(CCCc3nnc4cccc(C)n34)n12- InChIKey
QTGIRTGLRPKIPH-UHFFFAOYSA-N- Molecular formula
- C17H18N6
- Average molar mass
- 306.4 g/mol
- Monoisotopic mass
- 306.1592946
Names & identifiers
- Preferred name
- 3,3'-(Propane-1,3-diyl)bis(5-methyl[1,2,4]triazolo[4,3-a]pyridine)
- IUPAC
- 5-methyl-3-[3-(5-methyl-[1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]-[1,2,4]triazolo[4,3-a]pyridine
Names & synonyms
64762-60-3NSC303773DTXSID303164893,3'-(Propane-1,3-diyl)bis(5-methyl[1,2,4]triazolo[4,3-a]pyridine)NSC-303773
Database identifiers
- CAS
64762-60-3- PubChem CID
- 327707
- DTXSID
DTXSID30316489
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 60.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 369
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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