N-(3-nitrophenyl)-3,4-dihydro-1H-isoquinoline-2-carbothioamide
N-(3-nitrophenyl)-3,4-dihydro-1H-isoquinoline-2-carbothioamide
Also Known As: N-(3-nitrophenyl)-3,4-dihydro-1H-isoquinoline-2-carbothioamide|N-(3-nitrophenyl)-3,4-dihydro-2(1H)-isoquinolinecarbothioamide|N-(3-nitrophenyl)-3,4-dihydroisoquinoline-2(1H)-carbothioamide|[(3-nitrophenyl)amino]-2-1,2,3,4-tetrahydroisoquinolylmethane-1-thione
CAS: 708228-72-2
| Molecular Formula | C16H15N3O2S |
|---|---|
| Molecular Weight | 313.0885 g/mol |
| LogP | 3.3499 |
| Topological Polar Surface Area | 58.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 313.0885 |
| Monoisotopic Mass | 313.0885 |
| Heavy Atoms | 22 |
| Complexity | 732.8358 |
Chemical Identifiers
| CAS Number | 708228-72-2 |
|---|---|
| SMILES | C1CN(CC2=CC=CC=C21)C(=S)NC3=CC(=CC=C3)[N+](=O)[O-] |
Product Overview
N-(3-nitrophenyl)-3,4-dihydro-1H-isoquinoline-2-carbothioamide (CAS 708228-72-2), with molecular formula C16H15N3O2S and molecular weight 313.0885 g/mol. IUPAC: N-(3-nitrophenyl)-3,4-dihydro-1H-isoquinoline-2-carbothioamide.
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 →
N-(3-nitrophenyl)-3,4-dihydro-1H-isoquinoline-2-carbothioamide is a custom synthesis product. We offer services from milligram to kilogram scale.
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