N-[3-(4-methoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-2-phenylbutanamide
Chemical Structure Depiction of
N-[3-(4-methoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-2-phenylbutanamide
N-[3-(4-methoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-2-phenylbutanamide
Compound characteristics
| Compound ID: | E157-4091 |
| Compound Name: | N-[3-(4-methoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-2-phenylbutanamide |
| Molecular Weight: | 393.47 |
| Molecular Formula: | C20 H19 N5 O2 S |
| Smiles: | CCC(C(Nc1nn2c(c3ccc(cc3)OC)nnc2s1)=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.231 |
| logD: | 4.2206 |
| logSw: | -4.204 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.669 |
| InChI Key: | LQKOIUJGBQQBFM-MRXNPFEDSA-N |