N-[3-(3,4-dimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]cyclohexanecarboxamide
Chemical Structure Depiction of
N-[3-(3,4-dimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]cyclohexanecarboxamide
N-[3-(3,4-dimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]cyclohexanecarboxamide
Compound characteristics
| Compound ID: | E157-4417 |
| Compound Name: | N-[3-(3,4-dimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]cyclohexanecarboxamide |
| Molecular Weight: | 387.46 |
| Molecular Formula: | C18 H21 N5 O3 S |
| Smiles: | COc1ccc(cc1OC)c1nnc2n1nc(NC(C1CCCCC1)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 3.1073 |
| logD: | 3.1034 |
| logSw: | -3.4114 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.578 |
| InChI Key: | ALCXFWOMHIATQX-UHFFFAOYSA-N |