4(3H)-Quinazolinone, 6-bromo-2-methyl-3-((5-((3-methylphenyl)amino)-1,3,4-oxadiazol-2-yl)methyl)-
Basic information
- CAS
40889-65-4- Standard SMILES
Cc1cccc(Nc2nnc(Cn3c(C)nc4ccc(Br)cc4c3=O)o2)c1- InChIKey
TVQCZEQYODYEMN-UHFFFAOYSA-N- Molecular formula
- C19H16BrN5O2
- Average molar mass
- 426.3 g/mol
- Monoisotopic mass
- 425.04874
Names & identifiers
- Preferred name
- 4(3H)-Quinazolinone, 6-bromo-2-methyl-3-((5-((3-methylphenyl)amino)-1,3,4-oxadiazol-2-yl)methyl)-
- IUPAC
- 6-bromo-2-methyl-3-[[5-(3-methylanilino)-1,3,4-oxadiazol-2-yl]methyl]quinazolin-4-one
Names & synonyms
BRN 10471754(3H)-Quinazolinone, 6-bromo-2-methyl-3-((5-((3-methylphenyl)amino)-1,3,4-oxadiazol-2-yl)methyl)-40889-65-4DTXSID90193879RefChem:284253DTXCID801163706-Bromo-2-methyl-3-{[5-(3-methylanilino)-1,3,4-oxadiazol-2-yl]methyl}quinazolin-4(3H)-one
Database identifiers
- CAS
40889-65-4- PubChem CID
- 63774
- DTXSID
DTXSID90193879
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 83.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 588
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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