2-[2,5-dimethyl-4-(3-methyl-1,2-oxazol-5-yl)thiophene-3-sulfonyl]-1,2,3,4-tetrahydroisoquinoline
Chemical Structure Depiction of
2-[2,5-dimethyl-4-(3-methyl-1,2-oxazol-5-yl)thiophene-3-sulfonyl]-1,2,3,4-tetrahydroisoquinoline
2-[2,5-dimethyl-4-(3-methyl-1,2-oxazol-5-yl)thiophene-3-sulfonyl]-1,2,3,4-tetrahydroisoquinoline
Compound characteristics
| Compound ID: | F322-0479 |
| Compound Name: | 2-[2,5-dimethyl-4-(3-methyl-1,2-oxazol-5-yl)thiophene-3-sulfonyl]-1,2,3,4-tetrahydroisoquinoline |
| Molecular Weight: | 388.51 |
| Molecular Formula: | C19 H20 N2 O3 S2 |
| Smiles: | Cc1cc(c2c(c(C)sc2C)S(N2CCc3ccccc3C2)(=O)=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 4.0949 |
| logD: | 4.0949 |
| logSw: | -4.2803 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.971 |
| InChI Key: | AYIKPJAJGSEFGP-UHFFFAOYSA-N |