N-[(2-bromophenyl)methyl]-2-[(8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-[(2-bromophenyl)methyl]-2-[(8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)sulfanyl]acetamide
N-[(2-bromophenyl)methyl]-2-[(8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | C201-1184 |
| Compound Name: | N-[(2-bromophenyl)methyl]-2-[(8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)sulfanyl]acetamide |
| Molecular Weight: | 488.43 |
| Molecular Formula: | C20 H18 Br N5 O S2 |
| Smiles: | C1CCc2c(C1)c1c3nnc(n3C=Nc1s2)SCC(NCc1ccccc1[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 4.0184 |
| logD: | 4.0184 |
| logSw: | -4.3892 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.306 |
| InChI Key: | SLKODRAPWWZJOS-UHFFFAOYSA-N |