1H-(1,2,4)Triazolo(1,2-a)pyridazine-1,3(2H)-dione, tetrahydro-2-(3-chlorophenyl)-
Basic information
- CAS
58744-04-0- Standard SMILES
O=c1n(-c2cccc(Cl)c2)c(=O)n2n1CCCC2- InChIKey
ZWIVVRDOXJXMRU-UHFFFAOYSA-N- Molecular formula
- C12H12ClN3O2
- Average molar mass
- 265.69 g/mol
- Monoisotopic mass
- 265.0618043
Names & identifiers
- Preferred name
- 1H-(1,2,4)Triazolo(1,2-a)pyridazine-1,3(2H)-dione, tetrahydro-2-(3-chlorophenyl)-
- IUPAC
- 2-(3-chlorophenyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,2-a]pyridazine-1,3-dione
Names & synonyms
58744-04-0DTXSID302074441H-(1,2,4)Triazolo(1,2-a)pyridazine-1,3(2H)-dione, tetrahydro-2-(3-chlorophenyl)-2-(3-Chlorophenyl)-1H-tetrahydro(1,2,4)triazolo(1,2-a)pyridazine-1,3(2H)-dioneRefChem:236870DTXCID301299352-(3-chlorophenyl)tetrahydro-1H-[1,2,4]triazolo[1,2-a]pyridazine-1,3(2H)-dione1h-[1,2,4]triazolo[1,2-a]pyridazine-1,3(2h)-dione, 2-(3-chlorophenyl)tetrahydro-SCHEMBL11377597ZWIVVRDOXJXMRU-UHFFFAOYSA-NSTK665292AKOS005536086
Show more names
ST1071012-(3-CHLOROPHENYL)-TETRAHYDRO-[1,2,4]TRIAZOLO[1,2-A]PYRIDAZINE-1,3-DIONE
Database identifiers
- CAS
58744-04-0- PubChem CID
- 186708
- DTXSID
DTXSID30207444
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 43.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 352
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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