1,2,4-Triazolo(4,3-b)pyridazine, 7-(2-chlorophenyl)-3-methyl-
Basic information
- CAS
100078-93-1- Standard SMILES
Cc1nnc2cc(-c3ccccc3Cl)cnn12- InChIKey
AIQXYRJVUYPYBI-UHFFFAOYSA-N- Molecular formula
- C12H9ClN4
- Average molar mass
- 244.68 g/mol
- Monoisotopic mass
- 244.051574
Names & identifiers
- Preferred name
- 1,2,4-Triazolo(4,3-b)pyridazine, 7-(2-chlorophenyl)-3-methyl-
- IUPAC
- 7-(2-chlorophenyl)-3-methyl-[1,2,4]triazolo[4,3-b]pyridazine
Names & synonyms
SR 954371,2,4-Triazolo(4,3-b)pyridazine, 7-(2-chlorophenyl)-3-methyl-100078-93-17-(2-Chlorophenyl)-3-methyl-1,2,4-triazolo(4,3-b)pyridazineDTXSID80142912RefChem:215262DTXCID30654037-(2-Chlorophenyl)-3-methyl[1,2,4]triazolo[4,3-b]pyridazine
Database identifiers
- CAS
100078-93-1- PubChem CID
- 3063191
- DTXSID
DTXSID80142912
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 43.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 275
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Compound notes
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