1-phenyl-2-[(5,7,9-trimethyl[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]ethan-1-one
Chemical Structure Depiction of
1-phenyl-2-[(5,7,9-trimethyl[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]ethan-1-one
1-phenyl-2-[(5,7,9-trimethyl[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]ethan-1-one
Compound characteristics
| Compound ID: | D308-0353 |
| Compound Name: | 1-phenyl-2-[(5,7,9-trimethyl[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]ethan-1-one |
| Molecular Weight: | 361.46 |
| Molecular Formula: | C21 H19 N3 O S |
| Smiles: | Cc1cc(C)c2c(c1)c(C)cc1nnc(n12)SCC(c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.082 |
| logD: | 5.082 |
| logSw: | -4.9248 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 34.105 |
| InChI Key: | PREOQSKJXOWQKX-UHFFFAOYSA-N |