N-benzyl-N-ethyl-2-[(thieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-benzyl-N-ethyl-2-[(thieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8-yl)sulfanyl]acetamide
N-benzyl-N-ethyl-2-[(thieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | E513-0072 |
| Compound Name: | N-benzyl-N-ethyl-2-[(thieno[2',3':4,5]pyrrolo[1,2-d][1,2,4]triazin-8-yl)sulfanyl]acetamide |
| Molecular Weight: | 382.5 |
| Molecular Formula: | C19 H18 N4 O S2 |
| Smiles: | CCN(Cc1ccccc1)C(CSc1c2cc3c(ccs3)n2cnn1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1966 |
| logD: | 3.196 |
| logSw: | -3.2112 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.623 |
| InChI Key: | MBZHFEVOMHDMCH-UHFFFAOYSA-N |