2-(4-nitrobenzene-1-sulfonyl)-1,2,3,4-tetrahydroisoquinoline
Chemical Structure Depiction of
2-(4-nitrobenzene-1-sulfonyl)-1,2,3,4-tetrahydroisoquinoline
2-(4-nitrobenzene-1-sulfonyl)-1,2,3,4-tetrahydroisoquinoline
Compound characteristics
| Compound ID: | Y031-8465 |
| Compound Name: | 2-(4-nitrobenzene-1-sulfonyl)-1,2,3,4-tetrahydroisoquinoline |
| Molecular Weight: | 318.35 |
| Molecular Formula: | C15 H14 N2 O4 S |
| Smiles: | C1CN(Cc2ccccc12)S(c1ccc(cc1)[N+]([O-])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2518 |
| logD: | 3.2518 |
| logSw: | -3.5337 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 64.993 |
| InChI Key: | GFAJPJGKVNRLNV-UHFFFAOYSA-N |