1,1'-[3-ethyl-6-(5,6,7,8-tetrahydronaphthalen-2-yl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-5,7-diyl]di(ethan-1-one)
Chemical Structure Depiction of
1,1'-[3-ethyl-6-(5,6,7,8-tetrahydronaphthalen-2-yl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-5,7-diyl]di(ethan-1-one)
1,1'-[3-ethyl-6-(5,6,7,8-tetrahydronaphthalen-2-yl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-5,7-diyl]di(ethan-1-one)
Compound characteristics
| Compound ID: | G857-1407 |
| Compound Name: | 1,1'-[3-ethyl-6-(5,6,7,8-tetrahydronaphthalen-2-yl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-5,7-diyl]di(ethan-1-one) |
| Molecular Weight: | 382.48 |
| Molecular Formula: | C20 H22 N4 O2 S |
| Smiles: | CCc1nnc2n1N(C(=C(C(C)=O)S2)c1ccc2CCCCc2c1)C(C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3506 |
| logD: | 3.3506 |
| logSw: | -3.4374 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 54.583 |
| InChI Key: | VYXLUCSRBUHTRE-UHFFFAOYSA-N |