Basic information
- CAS
52459-32-2- Standard SMILES
NC(=O)c1nnn2c1nc(N)c1ccccc12- InChIKey
ZAPWLPOSXSOYIG-UHFFFAOYSA-N- Molecular formula
- C10H8N6O
- Average molar mass
- 228.21 g/mol
- Monoisotopic mass
- 228.0759589
Names & identifiers
- Preferred name
- 5-Amino[1,2,3]triazolo[1,5-a]quinazoline-3-carboxamide
- IUPAC
- 5-aminotriazolo[1,5-a]quinazoline-3-carboxamide
- English name
- 5-amino[1,2,3]triazolo[1,5-a]quinazoline-3-carboxamide
- Molecular formula
- C10H8N6O
- Molecular weight
- 228.21
Names & synonyms
52459-32-25-amino[1,2,3]triazolo[1,5-a]quinazoline-3-carboxamide5-aminotriazolo[1,5-a]quinazoline-3-carboxamide5-amino-[1,2,3]triazolo[1,5-a]quinazoline-3-carboxamideMFCD00119801NSC326654Oprea1_308485DTXSID00318152AKOS005081555NSC-326654SR-0100030797912W-0915
Show more names
[1,2,3]Triazolo[1,5-a]quinazoline-3-carboxamide, 5-amino-
SR-01000307979-15-imino-4H-triazolo[1,5-a]quinazoline-3-carboxamide5-Imino-4,5-dihydro[1,2,3]triazolo[1,5-a]quinazoline-3-carboxamide
Database identifiers
- CAS
52459-32-2- PubChem CID
- 331817
- DTXSID
DTXSID00318152
Properties
Computed structural properties
- XLogP
- 0
- Topological polar surface area
- 112 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 324
Physicochemical properties
- Density
- 1.84 · 1.84±0.1 g/cm3(Predicted)
- pka
- 10.76 · 10.76±0.50(Predicted)
Chemistry & industry
Suppliers3 total
Ryan Scientific, Inc.[email protected]
Key Organics Ltd.[email protected]
BIONET-INTER[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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