N-(4-fluorophenyl)-1,1-dioxo-3-(pyrrolidin-1-yl)-1H-1-benzothiophene-2-carboxamide
Chemical Structure Depiction of
N-(4-fluorophenyl)-1,1-dioxo-3-(pyrrolidin-1-yl)-1H-1-benzothiophene-2-carboxamide
N-(4-fluorophenyl)-1,1-dioxo-3-(pyrrolidin-1-yl)-1H-1-benzothiophene-2-carboxamide
Compound characteristics
| Compound ID: | J087-0425 |
| Compound Name: | N-(4-fluorophenyl)-1,1-dioxo-3-(pyrrolidin-1-yl)-1H-1-benzothiophene-2-carboxamide |
| Molecular Weight: | 372.42 |
| Molecular Formula: | C19 H17 F N2 O3 S |
| Smiles: | C1CCN(C1)C1=C(C(Nc2ccc(cc2)F)=O)S(c2ccccc12)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1073 |
| logD: | 3.1031 |
| logSw: | -3.7692 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.333 |
| InChI Key: | QLAUYTPYTPNGLI-UHFFFAOYSA-N |