N-[(5-bromofuran-2-yl)methyl]-2-(2,3-dimethylphenoxy)-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)acetamide
Chemical Structure Depiction of
N-[(5-bromofuran-2-yl)methyl]-2-(2,3-dimethylphenoxy)-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)acetamide
N-[(5-bromofuran-2-yl)methyl]-2-(2,3-dimethylphenoxy)-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)acetamide
Compound characteristics
| Compound ID: | D328-0070 |
| Compound Name: | N-[(5-bromofuran-2-yl)methyl]-2-(2,3-dimethylphenoxy)-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)acetamide |
| Molecular Weight: | 456.35 |
| Molecular Formula: | C19 H22 Br N O5 S |
| Smiles: | Cc1cccc(c1C)OCC(N(Cc1ccc(o1)[Br])C1CCS(C1)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8289 |
| logD: | 2.8289 |
| logSw: | -3.0599 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.014 |
| InChI Key: | HVSQSRROHLOPPF-HNNXBMFYSA-N |