4(3H)-Quinazolinone, 2-((2-benzothiazolylsulfonyl)methyl)-6,8-dibromo-3-(2-chlorophenyl)-
Basic information
- CAS
108659-82-1- Standard SMILES
O=c1c2cc(Br)cc(Br)c2nc(CS(=O)(=O)c2nc3ccccc3s2)n1-c1ccccc1Cl- InChIKey
VZRZDCCSLLSCRJ-UHFFFAOYSA-N- Molecular formula
- C22H12Br2ClN3O3S2
- Average molar mass
- 625.7 g/mol
- Monoisotopic mass
- 622.83754
Names & identifiers
- Preferred name
- 4(3H)-Quinazolinone, 2-((2-benzothiazolylsulfonyl)methyl)-6,8-dibromo-3-(2-chlorophenyl)-
- IUPAC
- 2-(1,3-benzothiazol-2-ylsulfonylmethyl)-6,8-dibromo-3-(2-chlorophenyl)quinazolin-4-one
Names & synonyms
108659-82-12-((2-Benzothiazolylsulfonyl)methyl)-6,8-dibromo-3-(2-chlorophenyl)-4(3H)-quinazolinone4(3H)-Quinazolinone, 2-((2-benzothiazolylsulfonyl)methyl)-6,8-dibromo-3-(2-chlorophenyl)-DTXSID40148672RefChem:283789DTXCID10711632-[(1,3-Benzothiazole-2-sulfonyl)methyl]-6,8-dibromo-3-(2-chlorophenyl)quinazolin-4(3H)-one
Database identifiers
- CAS
108659-82-1- PubChem CID
- 63663
- DTXSID
DTXSID40148672
Properties
Computed structural properties
- XLogP
- 6.2
- Topological polar surface area
- 116 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 902
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…