N-[2-(4-fluoro-3-methylbenzene-1-sulfonyl)-2-(thiophen-2-yl)ethyl]-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-[2-(4-fluoro-3-methylbenzene-1-sulfonyl)-2-(thiophen-2-yl)ethyl]-2H-1,3-benzodioxole-5-carboxamide
N-[2-(4-fluoro-3-methylbenzene-1-sulfonyl)-2-(thiophen-2-yl)ethyl]-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | G509-0198 |
| Compound Name: | N-[2-(4-fluoro-3-methylbenzene-1-sulfonyl)-2-(thiophen-2-yl)ethyl]-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 447.5 |
| Molecular Formula: | C21 H18 F N O5 S2 |
| Smiles: | Cc1cc(ccc1F)S(C(CNC(c1ccc2c(c1)OCO2)=O)c1cccs1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6172 |
| logD: | 3.6172 |
| logSw: | -3.8661 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.286 |
| InChI Key: | IQTJWOMSZNFYAT-FQEVSTJZSA-N |