3,4-Diamino-2-benzoyl-6-ethyl-7-methyl-1-benzothiophene-5-carbonitrile
3,4-diamino-2-benzoyl-6-ethyl-7-methyl-1-benzothiophene-5-carbonitrile
Also Known As: 3,4-diamino-2-benzoyl-6-ethyl-7-methyl-1-benzothiophene-5-carbonitrile
CAS: 78583-97-8
| Molecular Formula | C19H17N3OS |
|---|---|
| Molecular Weight | 335.10922 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 121.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 335.10922 |
| Monoisotopic Mass | 335.10922 |
| Heavy Atoms | 24 |
| Complexity | 524.0 |
Chemical Identifiers
| CAS Number | 78583-97-8 |
|---|---|
| SMILES | CCC1=C(C2=C(C(=C1C#N)N)C(=C(S2)C(=O)C3=CC=CC=C3)N)C |
| InChIKey | XGIQOFGDZPLEFI-UHFFFAOYSA-N |
Product Overview
3,4-Diamino-2-benzoyl-6-ethyl-7-methyl-1-benzothiophene-5-carbonitrile (CAS 78583-97-8), with molecular formula C19H17N3OS and molecular weight 335.10922 g/mol. IUPAC: 3,4-diamino-2-benzoyl-6-ethyl-7-methyl-1-benzothiophene-5-carbonitrile.
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 →
3,4-Diamino-2-benzoyl-6-ethyl-7-methyl-1-benzothiophene-5-carbonitrile is a custom synthesis product. We offer services from milligram to kilogram scale.
Request a Quote »