4(3H)-Quinazolinone, 3-(4-bromo-o-tolyl)-2-methyl-, monohydrochloride
Basic information
- CAS
40712-66-1- Standard SMILES
Cc1cc(Br)ccc1-n1c(C)nc2ccccc2c1=O.Cl- InChIKey
KNVLXYGGPVIBEH-UHFFFAOYSA-N- Molecular formula
- C16H14BrClN2O
- Average molar mass
- 365.65 g/mol
- Monoisotopic mass
- 363.9978
Names & identifiers
- Preferred name
- 4(3H)-Quinazolinone, 3-(4-bromo-o-tolyl)-2-methyl-, monohydrochloride
- IUPAC
- 3-(4-bromo-2-methylphenyl)-2-methylquinazolin-4-one;hydrochloride
Names & synonyms
40712-66-14(3H)-Quinazolinone, 3-(4-bromo-o-tolyl)-2-methyl-, monohydrochloride2-Metil-3-(o-tolil-p-bromo)-4-chinazolone cloridrato [Italian]3-(4-Bromo-o-tolyl)-2-methyl-4(3H)-quinazolinone hydrochlorideDTXSID501936983-(4-Bromo-2-methylphenyl)-2-methyl-4(3H)-quinazolinone hydrochloride2-Metil-3-(o-tolil-p-bromo)-4-chinazolone cloridratoRefChem:284072DTXCID901161893-(4-Bromo-2-methylphenyl)-2-methylquinazolin-4(3H)-one--hydrogen chloride (1/1)
Database identifiers
- CAS
40712-66-1- PubChem CID
- 63772
- DTXSID
DTXSID50193698
Properties
Computed structural properties
- Topological polar surface area
- 32.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 423
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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