N-(4-fluorophenyl)-1,1-dioxo-3-(4-phenylpiperazin-1-yl)-1H-1-benzothiophene-2-carboxamide
Chemical Structure Depiction of
N-(4-fluorophenyl)-1,1-dioxo-3-(4-phenylpiperazin-1-yl)-1H-1-benzothiophene-2-carboxamide
N-(4-fluorophenyl)-1,1-dioxo-3-(4-phenylpiperazin-1-yl)-1H-1-benzothiophene-2-carboxamide
Compound characteristics
| Compound ID: | J087-0426 |
| Compound Name: | N-(4-fluorophenyl)-1,1-dioxo-3-(4-phenylpiperazin-1-yl)-1H-1-benzothiophene-2-carboxamide |
| Molecular Weight: | 463.53 |
| Molecular Formula: | C25 H22 F N3 O3 S |
| Smiles: | C1CN(CCN1C1=C(C(Nc2ccc(cc2)F)=O)S(c2ccccc12)(=O)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.0212 |
| logD: | 4.0169 |
| logSw: | -4.271 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.227 |
| InChI Key: | NAHHSHIYJMYQSG-UHFFFAOYSA-N |