N-(3-butyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)-4-methoxybenzamide
Chemical Structure Depiction of
N-(3-butyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)-4-methoxybenzamide
N-(3-butyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)-4-methoxybenzamide
Compound characteristics
| Compound ID: | E157-3510 |
| Compound Name: | N-(3-butyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)-4-methoxybenzamide |
| Molecular Weight: | 331.39 |
| Molecular Formula: | C15 H17 N5 O2 S |
| Smiles: | CCCCc1nnc2n1nc(NC(c1ccc(cc1)OC)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 2.8155 |
| logD: | 2.6118 |
| logSw: | -3.4098 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.917 |
| InChI Key: | YCLJKNNKDPZRMH-UHFFFAOYSA-N |