3-(4-methylpiperazin-1-yl)-1,1-dioxo-N-phenyl-1H-1-benzothiophene-2-carboxamide
Chemical Structure Depiction of
3-(4-methylpiperazin-1-yl)-1,1-dioxo-N-phenyl-1H-1-benzothiophene-2-carboxamide
3-(4-methylpiperazin-1-yl)-1,1-dioxo-N-phenyl-1H-1-benzothiophene-2-carboxamide
Compound characteristics
| Compound ID: | J087-0067 |
| Compound Name: | 3-(4-methylpiperazin-1-yl)-1,1-dioxo-N-phenyl-1H-1-benzothiophene-2-carboxamide |
| Molecular Weight: | 383.47 |
| Molecular Formula: | C20 H21 N3 O3 S |
| Smiles: | CN1CCN(CC1)C1=C(C(Nc2ccccc2)=O)S(c2ccccc12)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9832 |
| logD: | 1.9398 |
| logSw: | -2.9518 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.444 |
| InChI Key: | ILGHDMCEWUQSKM-UHFFFAOYSA-N |