2-[5-(5-ethyl-1,2,4-oxadiazol-3-yl)-2-methylbenzene-1-sulfonyl]-1,2,3,4-tetrahydroisoquinoline
Chemical Structure Depiction of
2-[5-(5-ethyl-1,2,4-oxadiazol-3-yl)-2-methylbenzene-1-sulfonyl]-1,2,3,4-tetrahydroisoquinoline
2-[5-(5-ethyl-1,2,4-oxadiazol-3-yl)-2-methylbenzene-1-sulfonyl]-1,2,3,4-tetrahydroisoquinoline
Compound characteristics
| Compound ID: | G947-4409 |
| Compound Name: | 2-[5-(5-ethyl-1,2,4-oxadiazol-3-yl)-2-methylbenzene-1-sulfonyl]-1,2,3,4-tetrahydroisoquinoline |
| Molecular Weight: | 383.47 |
| Molecular Formula: | C20 H21 N3 O3 S |
| Smiles: | CCc1nc(c2ccc(C)c(c2)S(N2CCc3ccccc3C2)(=O)=O)no1 |
| Stereo: | ACHIRAL |
| logP: | 4.8277 |
| logD: | 4.8277 |
| logSw: | -4.5495 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 62.954 |
| InChI Key: | PZBHZATXESTTRO-UHFFFAOYSA-N |