5-methyl-1-{[(2-nitrophenyl)methyl]sulfanyl}[1,2,4]triazolo[4,3-a]quinoline
Chemical Structure Depiction of
5-methyl-1-{[(2-nitrophenyl)methyl]sulfanyl}[1,2,4]triazolo[4,3-a]quinoline
5-methyl-1-{[(2-nitrophenyl)methyl]sulfanyl}[1,2,4]triazolo[4,3-a]quinoline
Compound characteristics
| Compound ID: | 3230-0886 |
| Compound Name: | 5-methyl-1-{[(2-nitrophenyl)methyl]sulfanyl}[1,2,4]triazolo[4,3-a]quinoline |
| Molecular Weight: | 350.4 |
| Molecular Formula: | C18 H14 N4 O2 S |
| Smiles: | Cc1cc2nnc(n2c2ccccc12)SCc1ccccc1[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.6079 |
| logD: | 4.6079 |
| logSw: | -4.436 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 54.162 |
| InChI Key: | YMCLAGFDQLQXKF-UHFFFAOYSA-N |