2-[(5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-(5-phenyl-6H-1,3,4-thiadiazin-2-yl)acetamide
Chemical Structure Depiction of
2-[(5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-(5-phenyl-6H-1,3,4-thiadiazin-2-yl)acetamide
2-[(5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-(5-phenyl-6H-1,3,4-thiadiazin-2-yl)acetamide
Compound characteristics
| Compound ID: | D041-0013 |
| Compound Name: | 2-[(5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-(5-phenyl-6H-1,3,4-thiadiazin-2-yl)acetamide |
| Molecular Weight: | 447.54 |
| Molecular Formula: | C21 H17 N7 O S2 |
| Smiles: | Cn1c2ccccc2c2c1nc(nn2)SCC(NC1=NN=C(CS1)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3794 |
| logD: | 3.3785 |
| logSw: | -3.6557 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.621 |
| InChI Key: | URQKMDCSNHEODB-UHFFFAOYSA-N |