Ammonium, (2-((3,4-dihydro-7-chloro-4-oxo-3-phenyl-2-quinazolinyl)thio)ethyl)trimethyl-, iodide
Basic information
- CAS
15589-20-5- Standard SMILES
C[N+](C)(C)CCSc1nc2cc(Cl)ccc2c(=O)n1-c1ccccc1.[I-]- InChIKey
PFCLFTBUNCULFX-UHFFFAOYSA-M- Molecular formula
- C19H21ClIN3OS
- Average molar mass
- 501.8 g/mol
- Monoisotopic mass
- 501.01386
Names & identifiers
- Preferred name
- Ammonium, (2-((3,4-dihydro-7-chloro-4-oxo-3-phenyl-2-quinazolinyl)thio)ethyl)trimethyl-, iodide
- IUPAC
- 2-(7-chloro-4-oxo-3-phenylquinazolin-2-yl)sulfanylethyl-trimethylazanium iodide
Names & synonyms
Ammonium, (2-((3,4-dihydro-7-chloro-4-oxo-3-phenyl-2-quinazolinyl)thio)ethyl)trimethyl-, iodide15589-20-5RefChem:318699DTXSID809353062-[(7-Chloro-4-oxo-3-phenyl-3,4-dihydroquinazolin-2-yl)sulfanyl]-N,N,N-trimethylethan-1-aminium iodide
Database identifiers
- CAS
15589-20-5- PubChem CID
- 27407
- DTXSID
DTXSID80935306
Properties
Computed structural properties
- Topological polar surface area
- 58 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 513
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Compound notes
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