7-(1,3-benzothiazol-2-ylsulfanyl)-8-methyl-5H-[1,3]dioxolo[4,5-g]quinolin-6-one
Basic information
- CAS
523991-03-9- Standard SMILES
Cc1c(Sc2nc3ccccc3s2)c(=O)[nH]c2cc3c(cc12)OCO3- InChIKey
NXSISTWUDFKGKE-UHFFFAOYSA-N- Molecular formula
- C18H12N2O3S2
- Average molar mass
- 368.4 g/mol
- Monoisotopic mass
- 368.0289346
Names & identifiers
- Preferred name
- 7-(1,3-benzothiazol-2-ylsulfanyl)-8-methyl-5H-[1,3]dioxolo[4,5-g]quinolin-6-one
- IUPAC
- 7-(1,3-benzothiazol-2-ylsulfanyl)-8-methyl-5H-[1,3]dioxolo[4,5-g]quinolin-6-one
- English name
- 7-(1,3-benzothiazol-2-ylsulfanyl)-8-methyl[1,3]dioxolo[4,5-g]quinolin-6(5H)-one
- Molecular formula
- C18H12N2O3S2
- Molecular weight
- 368.43
Names & synonyms
7-(1,3-benzothiazol-2-ylsulfanyl)-8-methyl-5H-[1,3]dioxolo[4,5-g]quinolin-6-one523991-03-97-(1,3-benzothiazol-2-ylsulfanyl)-8-methyl[1,3]dioxolo[4,5-g]quinolin-6(5H)-oneZINC03641000ChemDiv2_004336HMS1381F02STK261656AKOS001689080IDI1_003051EU-0015609ST50763721F93622
Show more names
1,3-Dioxolo[4,5-g]quinolin-6(5H)-one, 7-(2-benzothiazolylthio)-8-methyl-
AJ-292/416949807-(1,3-benzothiazol-2-ylthio)-8-methyl[1,3]dioxolo[4,5-g]quinolin-6(5H)-one7-(BENZO[D]THIAZOL-2-YLTHIO)-8-METHYL-[1,3]DIOXOLO[4,5-G]QUINOLIN-6(5H)-ONE7-benzothiazol-2-ylthio-8-methyl-5-hydro-2H-1,3-dioxoleno[4,5-g]quinolin-6-one
Database identifiers
- CAS
523991-03-9- PubChem CID
- 2715905
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 114 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 599
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…