2-[(5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-[5-(phenoxymethyl)-1,3,4-thiadiazol-2-yl]acetamide
Chemical Structure Depiction of
2-[(5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-[5-(phenoxymethyl)-1,3,4-thiadiazol-2-yl]acetamide
2-[(5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-[5-(phenoxymethyl)-1,3,4-thiadiazol-2-yl]acetamide
Compound characteristics
| Compound ID: | 6290-0138 |
| Compound Name: | 2-[(5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-[5-(phenoxymethyl)-1,3,4-thiadiazol-2-yl]acetamide |
| Molecular Weight: | 463.54 |
| Molecular Formula: | C21 H17 N7 O2 S2 |
| Smiles: | Cn1c2ccccc2c2c1nc(nn2)SCC(Nc1nnc(COc2ccccc2)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3999 |
| logD: | 3.3119 |
| logSw: | -3.7188 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.205 |
| InChI Key: | SCOFFRAGURMSCZ-UHFFFAOYSA-N |