1,1'-[3-(4-chlorophenyl)-6-(3,4-dimethoxyphenyl)-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'-[3-(4-chlorophenyl)-6-(3,4-dimethoxyphenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-5,7-diyl]di(propan-1-one)
1,1'-[3-(4-chlorophenyl)-6-(3,4-dimethoxyphenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-5,7-diyl]di(propan-1-one)
Compound characteristics
| Compound ID: | G857-1412 |
| Compound Name: | 1,1'-[3-(4-chlorophenyl)-6-(3,4-dimethoxyphenyl)-5H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine-5,7-diyl]di(propan-1-one) |
| Molecular Weight: | 498.99 |
| Molecular Formula: | C24 H23 Cl N4 O4 S |
| Smiles: | CCC(C1=C(c2ccc(c(c2)OC)OC)N(C(CC)=O)n2c(c3ccc(cc3)[Cl])nnc2S1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5957 |
| logD: | 4.5957 |
| logSw: | -4.8175 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.101 |
| InChI Key: | ZJUWIKDGRHCSKO-UHFFFAOYSA-N |