Basic information
- CAS
86134-19-2- Standard SMILES
Cc1cc(-n2c(C)nc3ccccc3c2=O)on1- InChIKey
OBKNRVAXTAVHHJ-UHFFFAOYSA-N- Molecular formula
- C13H11N3O2
- Average molar mass
- 241.24 g/mol
- Monoisotopic mass
- 241.0851266
Names & identifiers
- Preferred name
- 2-Methyl-3-(3-methyl-5-isoxazolyl)-4(3H)-quinazolinone
- IUPAC
- 2-methyl-3-(3-methyl-1,2-oxazol-5-yl)quinazolin-4-one
Names & synonyms
86134-19-22-Methyl-3-(3-methyl-5-isoxazolyl)-4(3H)-quinazolinone8YR3OI3ITKNSC 3822874(3H)-Quinazolinone, 2-methyl-3-(3-methyl-5-isoxazolyl)-BRN 4478664UNII-8YR3OI3ITKNSC-382287DTXSID20235418RefChem:197847DTXCID20157909NSC382287
Show more names
2-Methyl-3-(3-methylisoxazol-5-yl)quinazolin-4(3H)-oneOBKNRVAXTAVHHJ-UHFFFAOYSA-NDS-0042352-methyl-3-(3-methylisoxazol-5-yl)quinazolin-4-one2-Methyl-3-(3-methyl-1,2-oxazol-5-yl)quinazolin-4(3H)-one
Database identifiers
- CAS
86134-19-2- PubChem CID
- 63642
- DTXSID
DTXSID20235418- UNII
- 8YR3OI3ITK
- Nikkaji
- J481.103H
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 58.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 382
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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