Basic information
- CAS
122037-29-0- Standard SMILES
Cn1nccc1-n1cnc2ccccc2c1=O- InChIKey
MMQOWKLWRQUTBY-UHFFFAOYSA-N- Molecular formula
- C12H10N4O
- Average molar mass
- 226.23 g/mol
- Monoisotopic mass
- 226.08546096
Names & identifiers
- Preferred name
- 4(3H)-Quinazolinone, 3-(1-methyl-1H-pyrazol-5-yl)-
- IUPAC
- 3-(2-methylpyrazol-3-yl)quinazolin-4-one
Names & synonyms
BRN 36147144(3H)-Quinazolinone, 3-(1-methyl-1H-pyrazol-5-yl)-122037-29-03-(1-Methyl-1H-pyrazol-5-yl)-4(3H)-quinazolinoneDTXSID60153485RefChem:283955DTXCID20759764(3H)-Quinazolinone, 3-(1-methylpyrazol-5-yl)-MMQOWKLWRQUTBY-UHFFFAOYSA-N3-(1-Methyl-1H-pyrazol-5-yl)quinazolin-4(3H)-one3-(1-Methyl-1H-pyrazol-5-yl)-4(3H)-quinazolinone #
Database identifiers
- CAS
122037-29-0- PubChem CID
- 63995
- DTXSID
DTXSID60153485- Nikkaji
- J325.601D
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 50.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 343
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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