N-[3-(methylsulfanyl)phenyl]-2-[(thieno[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-[(thieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8-yl)sulfanyl]acetamide
N-[3-(methylsulfanyl)phenyl]-2-[(thieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | E513-0044 |
| Compound Name: | N-[3-(methylsulfanyl)phenyl]-2-[(thieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8-yl)sulfanyl]acetamide |
| Molecular Weight: | 386.51 |
| Molecular Formula: | C17 H14 N4 O S3 |
| Smiles: | CSc1cccc(c1)NC(CSc1c2cc3c(ccs3)n2cnn1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4238 |
| logD: | 3.4232 |
| logSw: | -3.7933 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.093 |
| InChI Key: | TVNFPASBONTSEV-UHFFFAOYSA-N |