6-Amino-7-(1,1-dimethylpropoxy)-4(3H)-quinazolinone
Basic information
- CAS
1155554-58-7- Standard SMILES
CCC(C)(C)Oc1cc2nc[nH]c(=O)c2cc1N- InChIKey
IUZUNPRBKYVMDS-UHFFFAOYSA-N- Molecular formula
- C13H17N3O2
- Average molar mass
- 247.29 g/mol
- Monoisotopic mass
- 247.13207679
Names & identifiers
- Preferred name
- 6-Amino-7-(1,1-dimethylpropoxy)-4(3H)-quinazolinone
- IUPAC
- 6-amino-7-(2-methylbutan-2-yloxy)-3H-quinazolin-4-one
Names & synonyms
DTXSID4012238036-Amino-7-(1,1-dimethylpropoxy)-4(3H)-quinazolinone6-Amino-7-[(2-methylbutan-2-yl)oxy]quinazolin-4(1H)-one1155554-58-7
Database identifiers
- CAS
1155554-58-7- PubChem CID
- 136178653
- DTXSID
DTXSID401223803
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 76.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 354
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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