AC1L7A6I
4-(2-cyclohex-2-en-1-ylsulfanyl-1,3-benzothiazol-6-yl)-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione
Also Known As: 2-{2-[(Cyclohex-2-en-1-yl)sulfanyl]-1,3-benzothiazol-6-yl}-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione|4-(2-Cyclohex-2-en-1-ylsulfanyl-1,3-benzothiazol-6-yl)-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione
CAS: 76383-01-2
| Molecular Formula | C22H20N2O2S2 |
|---|---|
| Molecular Weight | 408.09662 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 104.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 408.09662 |
| Monoisotopic Mass | 408.09662 |
| Heavy Atoms | 28 |
| Complexity | 723.0 |
Chemical Identifiers
| CAS Number | 76383-01-2 |
|---|---|
| SMILES | C1CC=CC(C1)SC2=NC3=C(S2)C=C(C=C3)N4C(=O)C5C6CC(C5C4=O)C=C6 |
| InChIKey | LEFZOUDMQFBAFK-UHFFFAOYSA-N |
Product Overview
AC1L7A6I (CAS 76383-01-2), with molecular formula C22H20N2O2S2 and molecular weight 408.09662 g/mol. IUPAC: 4-(2-cyclohex-2-en-1-ylsulfanyl-1,3-benzothiazol-6-yl)-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
AC1L7A6I is a custom synthesis product. We offer services from milligram to kilogram scale.
Request a Quote »