3-[4-(dimethylamino)anilino]-N-methyl-1,1-dioxo-1H-1-benzothiophene-2-carboxamide
Chemical Structure Depiction of
3-[4-(dimethylamino)anilino]-N-methyl-1,1-dioxo-1H-1-benzothiophene-2-carboxamide
3-[4-(dimethylamino)anilino]-N-methyl-1,1-dioxo-1H-1-benzothiophene-2-carboxamide
Compound characteristics
| Compound ID: | D581-0073 |
| Compound Name: | 3-[4-(dimethylamino)anilino]-N-methyl-1,1-dioxo-1H-1-benzothiophene-2-carboxamide |
| Molecular Weight: | 357.43 |
| Molecular Formula: | C18 H19 N3 O3 S |
| Smiles: | CNC(C1=C(c2ccccc2S1(=O)=O)Nc1ccc(cc1)N(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 1.794 |
| logD: | 1.2682 |
| logSw: | -2.6506 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.257 |
| InChI Key: | STZGOMKLWNAJMB-UHFFFAOYSA-N |