3-(4-bromo-2-fluoroanilino)-1,1-dioxo-1H-1-benzothiophene-2-carboxamide
Chemical Structure Depiction of
3-(4-bromo-2-fluoroanilino)-1,1-dioxo-1H-1-benzothiophene-2-carboxamide
3-(4-bromo-2-fluoroanilino)-1,1-dioxo-1H-1-benzothiophene-2-carboxamide
Compound characteristics
| Compound ID: | D531-0256 |
| Compound Name: | 3-(4-bromo-2-fluoroanilino)-1,1-dioxo-1H-1-benzothiophene-2-carboxamide |
| Molecular Weight: | 397.22 |
| Molecular Formula: | C15 H10 Br F N2 O3 S |
| Smiles: | c1ccc2c(c1)C(=C(C(N)=O)S2(=O)=O)Nc1ccc(cc1F)[Br] |
| Stereo: | ACHIRAL |
| logP: | 2.3998 |
| logD: | -0.939 |
| logSw: | -3.1263 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 71.978 |
| InChI Key: | WRMPDAPHFODDNS-UHFFFAOYSA-N |