2-(3,4-dimethylphenoxy)-N-[3-(3-methylphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]acetamide
Chemical Structure Depiction of
2-(3,4-dimethylphenoxy)-N-[3-(3-methylphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]acetamide
2-(3,4-dimethylphenoxy)-N-[3-(3-methylphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]acetamide
Compound characteristics
| Compound ID: | E157-4613 |
| Compound Name: | 2-(3,4-dimethylphenoxy)-N-[3-(3-methylphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]acetamide |
| Molecular Weight: | 393.47 |
| Molecular Formula: | C20 H19 N5 O2 S |
| Smiles: | Cc1cccc(c1)c1nnc2n1nc(NC(COc1ccc(C)c(C)c1)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 4.643 |
| logD: | 4.642 |
| logSw: | -4.4539 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.411 |
| InChI Key: | BIBNKJBEMKYFML-UHFFFAOYSA-N |