2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(2,2,4,6,7-pentamethylquinolin-1(2H)-yl)-2-phenylethan-1-one
Chemical Structure Depiction of
2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(2,2,4,6,7-pentamethylquinolin-1(2H)-yl)-2-phenylethan-1-one
2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(2,2,4,6,7-pentamethylquinolin-1(2H)-yl)-2-phenylethan-1-one
Compound characteristics
| Compound ID: | Y020-0267 |
| Compound Name: | 2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1-(2,2,4,6,7-pentamethylquinolin-1(2H)-yl)-2-phenylethan-1-one |
| Molecular Weight: | 449.64 |
| Molecular Formula: | C25 H27 N3 O S2 |
| Smiles: | CC1=CC(C)(C)N(C(C(c2ccccc2)Sc2nnc(C)s2)=O)c2cc(C)c(C)cc12 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.4506 |
| logD: | 6.4506 |
| logSw: | -5.7352 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.724 |
| InChI Key: | HHYTWNONGFBIMU-JOCHJYFZSA-N |