1,1'-[6-(3,4-dichlorophenyl)-3-ethyl-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'-[6-(3,4-dichlorophenyl)-3-ethyl-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-5,7-diyl]di(ethan-1-one)
1,1'-[6-(3,4-dichlorophenyl)-3-ethyl-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-5,7-diyl]di(ethan-1-one)
Compound characteristics
| Compound ID: | G857-1416 |
| Compound Name: | 1,1'-[6-(3,4-dichlorophenyl)-3-ethyl-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-5,7-diyl]di(ethan-1-one) |
| Molecular Weight: | 397.28 |
| Molecular Formula: | C16 H14 Cl2 N4 O2 S |
| Smiles: | CCc1nnc2n1N(C(=C(C(C)=O)S2)c1ccc(c(c1)[Cl])[Cl])C(C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2616 |
| logD: | 3.2616 |
| logSw: | -3.5601 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 54.662 |
| InChI Key: | ZFCOGQUYLPDBAZ-UHFFFAOYSA-N |