Oprea1_724730
ethyl 6-benzamido-12,12-dimethyl-4,11-dithia-2-azatricyclo[7.4.0.03,7]trideca-1,3(7),5,8-tetraene-5-carboxylate
Also Known As: Oprea1_724730|ethyl 3-benzamido-7,7-dimethyl-7,8-dihydro-5H-thieno[2,3-b]thiopyrano[3,4-e]pyridine-2-carboxylate|ethyl 7,7-dimethyl-3-[(phenylcarbonyl)amino]-7,8-dihydro-5H-thieno[2,3-b]thiopyrano[3,4-e]pyridine-2-carboxylate
CAS: 200959-70-2
| Molecular Formula | C22H22N2O3S2 |
|---|---|
| Molecular Weight | 426.10718 g/mol |
| LogP | 5.2932 |
| Topological Polar Surface Area | 68.29 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 426.10718 |
| Monoisotopic Mass | 426.10718 |
| Heavy Atoms | 29 |
| Complexity | 1090.3805 |
Chemical Identifiers
| CAS Number | 200959-70-2 |
|---|---|
| SMILES | CCOC(=O)C1=C(C2=C(S1)N=C3CC(SCC3=C2)(C)C)NC(=O)C4=CC=CC=C4 |
Product Overview
Oprea1_724730 (CAS 200959-70-2), with molecular formula C22H22N2O3S2 and molecular weight 426.10718 g/mol. IUPAC: ethyl 6-benzamido-12,12-dimethyl-4,11-dithia-2-azatricyclo[7.4.0.03,7]trideca-1,3(7),5,8-tetraene-5-carboxylate.
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 →
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