N-((4-Aminopyrazolo(5,1-c)(1,2,4)triazine-3-carbonyl)amino)formamide
Basic information
- CAS
16111-79-8- Standard SMILES
Nc1c(C(=O)NNC=O)nnc2ccnn12- InChIKey
XNSHTOSUNFBYOQ-UHFFFAOYSA-N- Molecular formula
- C7H7N7O2
- Average molar mass
- 221.18 g/mol
- Monoisotopic mass
- 221.06612249
Names & identifiers
- Preferred name
- N-((4-Aminopyrazolo(5,1-c)(1,2,4)triazine-3-carbonyl)amino)formamide
- IUPAC
- N-[(4-aminopyrazolo[5,1-c][1,2,4]triazine-3-carbonyl)amino]formamide
- English name
- N'-Formyl-4-aminopyrazolo[5,1-c][1,2,4]triazine-3-carbohydrazide
- Molecular formula
- C7H7N7O2
- Molecular weight
- 221.18
Names & synonyms
16111-79-8DTXSID20167068N-((4-Aminopyrazolo(5,1-c)(1,2,4)triazine-3-carbonyl)amino)formamideN-[(4-aminopyrazolo[5,1-c][1,2,4]triazine-3-carbonyl)amino]formamideRefChem:359649DTXCID6089559XNSHTOSUNFBYOQ-UHFFFAOYSA-N4-Amino-N'-formylpyrazolo[5,1-c][1,2,4]triazine-3-carbohydrazideN/'-Formyl-4-aminopyrazolo[5,1-c][1,2,4]triazine-3-carbohydrazideHydrazine, 1-[(4-aminopyrazolo[5,1-c]-as-triazin-3-yl)carbonyl]-2-formyl-4-Amino-N'-formylpyrazolo[5,1-c][1,2,4]triazine-3-carbohydrazide #N'-Formyl-4-aminopyrazolo[5,1-c][1,2,4]triazine-3-carbohydrazide
Show more names
Pyrazolo[5,1-c][1,2,4]triazine-3-carboxylic acid, 4-amino-, 2-formylhydrazide
Database identifiers
- CAS
16111-79-8- PubChem CID
- 27688
- DTXSID
DTXSID20167068- Nikkaji
- J102.787E
Properties
Computed structural properties
- XLogP
- -1.3
- Topological polar surface area
- 127 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 286
Physicochemical properties
- Density
- 1.93 · 1.93±0.1 g/cm3(Predicted)
- pka
- 6.86 · 6.86±0.43(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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