2-phenylethyl [(5-methyl[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]acetate
Chemical Structure Depiction of
2-phenylethyl [(5-methyl[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]acetate
2-phenylethyl [(5-methyl[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]acetate
Compound characteristics
| Compound ID: | D278-1118 |
| Compound Name: | 2-phenylethyl [(5-methyl[1,2,4]triazolo[4,3-a]quinolin-1-yl)sulfanyl]acetate |
| Molecular Weight: | 377.46 |
| Molecular Formula: | C21 H19 N3 O2 S |
| Smiles: | Cc1cc2nnc(n2c2ccccc12)SCC(=O)OCCc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.5702 |
| logD: | 4.5702 |
| logSw: | -4.4087 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.535 |
| InChI Key: | RLLYFALXQJZIPZ-UHFFFAOYSA-N |