1,1'-(6-phenyl-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-5,7-diyl)di(propan-1-one)
Chemical Structure Depiction of
1,1'-(6-phenyl-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-5,7-diyl)di(propan-1-one)
1,1'-(6-phenyl-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-5,7-diyl)di(propan-1-one)
Compound characteristics
| Compound ID: | G857-1294 |
| Compound Name: | 1,1'-(6-phenyl-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-5,7-diyl)di(propan-1-one) |
| Molecular Weight: | 328.39 |
| Molecular Formula: | C16 H16 N4 O2 S |
| Smiles: | CCC(C1=C(c2ccccc2)N(C(CC)=O)n2cnnc2S1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1972 |
| logD: | 2.1972 |
| logSw: | -2.2987 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 55.238 |
| InChI Key: | XMCITWCQNSXPIY-UHFFFAOYSA-N |