ethyl [(5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetate
Chemical Structure Depiction of
ethyl [(5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetate
ethyl [(5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetate
Compound characteristics
| Compound ID: | 4420-0542 |
| Compound Name: | ethyl [(5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetate |
| Molecular Weight: | 302.35 |
| Molecular Formula: | C14 H14 N4 O2 S |
| Smiles: | CCOC(CSc1nc2c(c3ccccc3n2C)nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2125 |
| logD: | 2.2125 |
| logSw: | -2.451 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 54.219 |
| InChI Key: | GETKLFGLJPYMMS-UHFFFAOYSA-N |