3-[4-(2-methoxyphenyl)piperazin-1-yl]-1,1-dioxo-1H-1-benzothiophene-2-carboxamide
Chemical Structure Depiction of
3-[4-(2-methoxyphenyl)piperazin-1-yl]-1,1-dioxo-1H-1-benzothiophene-2-carboxamide
3-[4-(2-methoxyphenyl)piperazin-1-yl]-1,1-dioxo-1H-1-benzothiophene-2-carboxamide
Compound characteristics
| Compound ID: | D531-0576 |
| Compound Name: | 3-[4-(2-methoxyphenyl)piperazin-1-yl]-1,1-dioxo-1H-1-benzothiophene-2-carboxamide |
| Molecular Weight: | 399.47 |
| Molecular Formula: | C20 H21 N3 O4 S |
| Smiles: | COc1ccccc1N1CCN(CC1)C1=C(C(N)=O)S(c2ccccc12)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7799 |
| logD: | 1.7799 |
| logSw: | -2.565 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.525 |
| InChI Key: | VBRYXHRNGYREMP-UHFFFAOYSA-N |