N-(4-fluorophenyl)-1,1-dioxo-3-[(2-phenoxyethyl)amino]-1H-1-benzothiophene-2-carboxamide
Chemical Structure Depiction of
N-(4-fluorophenyl)-1,1-dioxo-3-[(2-phenoxyethyl)amino]-1H-1-benzothiophene-2-carboxamide
N-(4-fluorophenyl)-1,1-dioxo-3-[(2-phenoxyethyl)amino]-1H-1-benzothiophene-2-carboxamide
Compound characteristics
| Compound ID: | J087-0496 |
| Compound Name: | N-(4-fluorophenyl)-1,1-dioxo-3-[(2-phenoxyethyl)amino]-1H-1-benzothiophene-2-carboxamide |
| Molecular Weight: | 438.48 |
| Molecular Formula: | C23 H19 F N2 O4 S |
| Smiles: | C(COc1ccccc1)NC1=C(C(Nc2ccc(cc2)F)=O)S(c2ccccc12)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.737 |
| logD: | 3.7357 |
| logSw: | -4.183 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.289 |
| InChI Key: | KKVMLHSLGKLREM-UHFFFAOYSA-N |