2-(2,1,3-benzoxadiazole-4-sulfonyl)-1,2,3,4-tetrahydroisoquinoline
Chemical Structure Depiction of
2-(2,1,3-benzoxadiazole-4-sulfonyl)-1,2,3,4-tetrahydroisoquinoline
2-(2,1,3-benzoxadiazole-4-sulfonyl)-1,2,3,4-tetrahydroisoquinoline
Compound characteristics
| Compound ID: | Y200-5392 |
| Compound Name: | 2-(2,1,3-benzoxadiazole-4-sulfonyl)-1,2,3,4-tetrahydroisoquinoline |
| Molecular Weight: | 315.35 |
| Molecular Formula: | C15 H13 N3 O3 S |
| Smiles: | C1CN(Cc2ccccc12)S(c1cccc2c1non2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2693 |
| logD: | 3.2693 |
| logSw: | -3.2427 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 67.701 |
| InChI Key: | UCEQBZMIDMAOFH-UHFFFAOYSA-N |