7-Amino-6-methyl(1,2,4)triazolo(4,3-b)pyridazin-8(5H)-one
Basic information
- CAS
32002-31-6- Standard SMILES
Cc1[nH]n2cnnc2c(=O)c1N- InChIKey
QRMPQVMUOVXNAB-UHFFFAOYSA-N- Molecular formula
- C6H7N5O
- Average molar mass
- 165.15 g/mol
- Monoisotopic mass
- 165.06505986
Names & identifiers
- Preferred name
- 7-Amino-6-methyl(1,2,4)triazolo(4,3-b)pyridazin-8(5H)-one
- IUPAC
- 7-amino-6-methyl-5H-[1,2,4]triazolo[4,3-b]pyridazin-8-one
- English name
- 4-amino-3-methyl-1,2,7,8-tetrazabicyclo[4.3.0]nona-3,6,8-trien-5-one
- Molecular formula
- C6H7N5O
- Molecular weight
- 165.15
Names & synonyms
DTXSID809538887-amino-6-methyl[1,2,4]triazolo[4,3-b]pyridazin-8(5h)-one7-Amino-6-methyl(1,2,4)triazolo(4,3-b)pyridazin-8(5H)-oneRefChem:1074351DTXCID80138192832002-31-67-amino-6-methyl-[1,2,4]triazolo[4,3-b]pyridazin-8-olBRN 12130767-Amino-6-methyl-[1,2,4]triazolo-[4,3-b]pyridazin-8-ol7-amino-6-methyl-5H-[1,2,4]triazolo[4,3-b]pyridazin-8-one7-Amino-6-methyl-s-triazolo(4,3-b)pyridazin-8-ols-Triazolo(4,3-b)pyridazin-8-ol, 7-amino-6-methyl-
Show more names
1,2,4-Triazolo[4,3-b]pyridazin-8-ol, 7-amino-6-methyl-
1,2,4-Triazolo[4,3-b]pyridazin-8-ol,7-amino-6-methyl-AKOS0062784364-AMINO-3-METHYL-1,2,7,8-TETRAZABICYCLO[4.3.0]NONA-3,6,8-TRIEN-5-ONEST510339877-amino-6-methyl-4-hydro-1,2,4-triazolo[4,3-e]pyridazin-8-ol
Database identifiers
- CAS
32002-31-6- PubChem CID
- 208339
- DTXSID
DTXSID80953888- Nikkaji
- J92.739B
Properties
Computed structural properties
- XLogP
- -0.3
- Topological polar surface area
- 85.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 261
Experimental & physicochemical properties
LogP-0.52
Physicochemical properties
- Density
- 1.83 · 1.83±0.1 g/cm3(Predicted)
- pka
- 8.42 · 8.42±0.30(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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