1,1'-[6-(4-methoxyphenyl)-3-methyl-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-(4-methoxyphenyl)-3-methyl-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-5,7-diyl]di(ethan-1-one)
1,1'-[6-(4-methoxyphenyl)-3-methyl-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-5,7-diyl]di(ethan-1-one)
Compound characteristics
Compound ID: | G857-1436 |
Compound Name: | 1,1'-[6-(4-methoxyphenyl)-3-methyl-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-5,7-diyl]di(ethan-1-one) |
Molecular Weight: | 344.39 |
Molecular Formula: | C16 H16 N4 O3 S |
Smiles: | CC(C1=C(c2ccc(cc2)OC)N(C(C)=O)n2c(C)nnc2S1)=O |
Stereo: | ACHIRAL |
logP: | 1.3555 |
logD: | 1.3555 |
logSw: | -2.1246 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 62.007 |
InChI Key: | XCGGNZXBZHCEEU-UHFFFAOYSA-N |