2-{[3-(4-bromophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-N-(2-methylphenyl)acetamide
Basic information
- CAS
840477-37-4- Standard SMILES
Cc1ccccc1NC(=O)CSc1nc2ccccc2c(=O)n1-c1ccc(Br)cc1- InChIKey
KQGBDKVOLYYSDP-UHFFFAOYSA-N- Molecular formula
- C23H18BrN3O2S
- Average molar mass
- 480.4 g/mol
- Monoisotopic mass
- 479.03031
Names & identifiers
- Preferred name
- 2-{[3-(4-bromophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-N-(2-methylphenyl)acetamide
- IUPAC
- 2-[3-(4-bromophenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(2-methylphenyl)acetamide
Names & synonyms
2-((3-(4-bromophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl)thio)-N-(o-tolyl)acetamideSTK554667AKOS0054812572-{[3-(4-bromophenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}-N-(2-methylphenyl)acetamide2-{[3-(4-bromophenyl)-4-oxo-3,4-dihydro-2-quinazolinyl]sulfanyl}-N-(2-methylphenyl)acetamide
Database identifiers
- CAS
840477-37-4- PubChem CID
- 1890455
- EC Number
- 142-482-6
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 87.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 665
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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