2-{4-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]thiophene-2-sulfonyl}-1,2,3,4-tetrahydroisoquinoline
Chemical Structure Depiction of
2-{4-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]thiophene-2-sulfonyl}-1,2,3,4-tetrahydroisoquinoline
2-{4-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]thiophene-2-sulfonyl}-1,2,3,4-tetrahydroisoquinoline
Compound characteristics
Compound ID: | L828-0086 |
Compound Name: | 2-{4-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]thiophene-2-sulfonyl}-1,2,3,4-tetrahydroisoquinoline |
Molecular Weight: | 457.96 |
Molecular Formula: | C21 H16 Cl N3 O3 S2 |
Smiles: | C1CN(Cc2ccccc12)S(c1cc(cs1)c1nc(c2ccc(cc2)[Cl])no1)(=O)=O |
Stereo: | ACHIRAL |
logP: | 5.7177 |
logD: | 5.7177 |
logSw: | -6.2127 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 64.035 |
InChI Key: | RZSCNALDFKPPGX-UHFFFAOYSA-N |