N-[3-(methylsulfanyl)phenyl]-2-[(5-methylthieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-[3-(methylsulfanyl)phenyl]-2-[(5-methylthieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8-yl)sulfanyl]acetamide
N-[3-(methylsulfanyl)phenyl]-2-[(5-methylthieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | E513-0824 |
| Compound Name: | N-[3-(methylsulfanyl)phenyl]-2-[(5-methylthieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8-yl)sulfanyl]acetamide |
| Molecular Weight: | 400.54 |
| Molecular Formula: | C18 H16 N4 O S3 |
| Smiles: | Cc1nnc(c2cc3c(ccs3)n12)SCC(Nc1cccc(c1)SC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5716 |
| logD: | 3.5696 |
| logSw: | -3.7275 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.264 |
| InChI Key: | WYHCATPJCCXSEZ-UHFFFAOYSA-N |