2-[2-(4-chlorobenzene-1-sulfonyl)-1,2,3,4-tetrahydroisoquinolin-1-yl]-N-[(5-methylfuran-2-yl)methyl]acetamide
Chemical Structure Depiction of
2-[2-(4-chlorobenzene-1-sulfonyl)-1,2,3,4-tetrahydroisoquinolin-1-yl]-N-[(5-methylfuran-2-yl)methyl]acetamide
2-[2-(4-chlorobenzene-1-sulfonyl)-1,2,3,4-tetrahydroisoquinolin-1-yl]-N-[(5-methylfuran-2-yl)methyl]acetamide
Compound characteristics
| Compound ID: | F714-0231 |
| Compound Name: | 2-[2-(4-chlorobenzene-1-sulfonyl)-1,2,3,4-tetrahydroisoquinolin-1-yl]-N-[(5-methylfuran-2-yl)methyl]acetamide |
| Molecular Weight: | 458.96 |
| Molecular Formula: | C23 H23 Cl N2 O4 S |
| Smiles: | Cc1ccc(CNC(CC2c3ccccc3CCN2S(c2ccc(cc2)[Cl])(=O)=O)=O)o1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7099 |
| logD: | 4.7099 |
| logSw: | -4.7639 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.388 |
| InChI Key: | BBYIRVWMZSURBX-QFIPXVFZSA-N |