4-(4-tert-butyl-1,3-thiazol-2-yl)-N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]thiophene-2-sulfonamide
Chemical Structure Depiction of
4-(4-tert-butyl-1,3-thiazol-2-yl)-N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]thiophene-2-sulfonamide
4-(4-tert-butyl-1,3-thiazol-2-yl)-N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]thiophene-2-sulfonamide
Compound characteristics
| Compound ID: | M022-1827 |
| Compound Name: | 4-(4-tert-butyl-1,3-thiazol-2-yl)-N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]thiophene-2-sulfonamide |
| Molecular Weight: | 461.67 |
| Molecular Formula: | C22 H27 N3 O2 S3 |
| Smiles: | CC(C)(C)c1csc(c2cc(sc2)S(NCCN2CCc3ccccc3C2)(=O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.4429 |
| logD: | 5.372 |
| logSw: | -5.3992 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.235 |
| InChI Key: | DODCOVZMYRUBPL-UHFFFAOYSA-N |