3-(4-acetamidoanilino)-N-(4-fluorophenyl)-1,1-dioxo-1H-1-benzothiophene-2-carboxamide
Chemical Structure Depiction of
3-(4-acetamidoanilino)-N-(4-fluorophenyl)-1,1-dioxo-1H-1-benzothiophene-2-carboxamide
3-(4-acetamidoanilino)-N-(4-fluorophenyl)-1,1-dioxo-1H-1-benzothiophene-2-carboxamide
Compound characteristics
| Compound ID: | J087-0450 |
| Compound Name: | 3-(4-acetamidoanilino)-N-(4-fluorophenyl)-1,1-dioxo-1H-1-benzothiophene-2-carboxamide |
| Molecular Weight: | 451.48 |
| Molecular Formula: | C23 H18 F N3 O4 S |
| Smiles: | CC(Nc1ccc(cc1)NC1=C(C(Nc2ccc(cc2)F)=O)S(c2ccccc12)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8391 |
| logD: | 2.7644 |
| logSw: | -3.8046 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 84.97 |
| InChI Key: | AYEKUBWXDXBRRJ-UHFFFAOYSA-N |