3-(3-bromoanilino)-1,1-dioxo-1H-1-benzothiophene-2-carboxamide
Chemical Structure Depiction of
3-(3-bromoanilino)-1,1-dioxo-1H-1-benzothiophene-2-carboxamide
3-(3-bromoanilino)-1,1-dioxo-1H-1-benzothiophene-2-carboxamide
Compound characteristics
| Compound ID: | D531-0336 |
| Compound Name: | 3-(3-bromoanilino)-1,1-dioxo-1H-1-benzothiophene-2-carboxamide |
| Molecular Weight: | 379.23 |
| Molecular Formula: | C15 H11 Br N2 O3 S |
| Smiles: | c1ccc2c(c1)C(=C(C(N)=O)S2(=O)=O)Nc1cccc(c1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 2.2039 |
| logD: | 0.6559 |
| logSw: | -3.0696 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 72.676 |
| InChI Key: | SHKYXKNNZPZFRN-UHFFFAOYSA-N |