N-[3-(3,4-dimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-3,4,5-trimethoxybenzamide
Chemical Structure Depiction of
N-[3-(3,4-dimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-3,4,5-trimethoxybenzamide
N-[3-(3,4-dimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-3,4,5-trimethoxybenzamide
Compound characteristics
| Compound ID: | E157-3692 |
| Compound Name: | N-[3-(3,4-dimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-3,4,5-trimethoxybenzamide |
| Molecular Weight: | 471.49 |
| Molecular Formula: | C21 H21 N5 O6 S |
| Smiles: | COc1ccc(cc1OC)c1nnc2n1nc(NC(c1cc(c(c(c1)OC)OC)OC)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 2.7059 |
| logD: | 2.7051 |
| logSw: | -3.409 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 95.364 |
| InChI Key: | YDHJTNCGMNDSDB-UHFFFAOYSA-N |