AC1NA3L1
4-(3,4-dimethoxyphenyl)-1-pentan-3-yl-4,8-dihydro-2H-pyrazolo[3,4-e][1,4]thiazepine-3,7-dione
Also Known As: 4-(3,4-dimethoxyphenyl)-1-pentan-3-yl-4,8-dihydro-2H-pyrazolo[3,4-e][1,4]thiazepine-3,7-dione|4-(3,4-dimethoxyphenyl)-3-hydroxy-1-(pentan-3-yl)-6,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7(4H)-one|4-(3,4-dimethoxyphenyl)-7-hydroxy-1-(pentan-3-yl)-1,2,4,6-tetrahydro-3H-pyrazolo[3,4-e][1,4]thiazepin-3-one
CAS: 674357-07-4
| Molecular Formula | C19H25N3O4S |
|---|---|
| Molecular Weight | 391.1566 g/mol |
| LogP | 3.3294 |
| Topological Polar Surface Area | 85.35 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 391.1566 |
| Monoisotopic Mass | 391.1566 |
| Heavy Atoms | 27 |
| Complexity | 885.5653 |
Chemical Identifiers
| CAS Number | 674357-07-4 |
|---|---|
| SMILES | CCC(CC)N1C2=C(C(SCC(=O)N2)C3=CC(=C(C=C3)OC)OC)C(=O)N1 |
Product Overview
AC1NA3L1 (CAS 674357-07-4), with molecular formula C19H25N3O4S and molecular weight 391.1566 g/mol. IUPAC: 4-(3,4-dimethoxyphenyl)-1-pentan-3-yl-4,8-dihydro-2H-pyrazolo[3,4-e][1,4]thiazepine-3,7-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.
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