2-(4-bromo-3-ethoxybenzene-1-sulfonyl)-1,2,3,4-tetrahydroisoquinoline
Chemical Structure Depiction of
2-(4-bromo-3-ethoxybenzene-1-sulfonyl)-1,2,3,4-tetrahydroisoquinoline
2-(4-bromo-3-ethoxybenzene-1-sulfonyl)-1,2,3,4-tetrahydroisoquinoline
Compound characteristics
| Compound ID: | 8018-5995 |
| Compound Name: | 2-(4-bromo-3-ethoxybenzene-1-sulfonyl)-1,2,3,4-tetrahydroisoquinoline |
| Molecular Weight: | 396.3 |
| Molecular Formula: | C17 H18 Br N O3 S |
| Smiles: | CCOc1cc(ccc1[Br])S(N1CCc2ccccc2C1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3631 |
| logD: | 4.3631 |
| logSw: | -4.1898 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 38.821 |
| InChI Key: | KRXYNOJNDQQXFU-UHFFFAOYSA-N |