2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(2,2,4,6-tetramethylquinolin-1(2H)-yl)ethan-1-one
Chemical Structure Depiction of
2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(2,2,4,6-tetramethylquinolin-1(2H)-yl)ethan-1-one
2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(2,2,4,6-tetramethylquinolin-1(2H)-yl)ethan-1-one
Compound characteristics
| Compound ID: | 4802-0182 |
| Compound Name: | 2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(2,2,4,6-tetramethylquinolin-1(2H)-yl)ethan-1-one |
| Molecular Weight: | 359.51 |
| Molecular Formula: | C18 H21 N3 O S2 |
| Smiles: | CC1=CC(C)(C)N(C(CSc2nnc(C)s2)=O)c2ccc(C)cc12 |
| Stereo: | ACHIRAL |
| logP: | 3.9595 |
| logD: | 3.9595 |
| logSw: | -3.9522 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.468 |
| InChI Key: | FMBLBOACTYGHCS-UHFFFAOYSA-N |