2-[(5-ethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetamide
Chemical Structure Depiction of
2-[(5-ethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetamide
2-[(5-ethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetamide
Compound characteristics
| Compound ID: | 5471-0049 |
| Compound Name: | 2-[(5-ethyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)acetamide |
| Molecular Weight: | 424.54 |
| Molecular Formula: | C20 H20 N6 O S2 |
| Smiles: | CCn1c2ccccc2c2c1nc(nn2)SCC(Nc1nc2CCCCc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3705 |
| logD: | 4.3081 |
| logSw: | -4.1871 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.32 |
| InChI Key: | WNJFRRGJWKNQTO-UHFFFAOYSA-N |