3,5-dimethoxy-N-{[4-(3-methyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]methyl}benzamide
Chemical Structure Depiction of
3,5-dimethoxy-N-{[4-(3-methyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]methyl}benzamide
3,5-dimethoxy-N-{[4-(3-methyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]methyl}benzamide
Compound characteristics
| Compound ID: | J011-0189 |
| Compound Name: | 3,5-dimethoxy-N-{[4-(3-methyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]methyl}benzamide |
| Molecular Weight: | 409.47 |
| Molecular Formula: | C20 H19 N5 O3 S |
| Smiles: | Cc1nnc2n1nc(c1ccc(CNC(c3cc(cc(c3)OC)OC)=O)cc1)s2 |
| Stereo: | ACHIRAL |
| logP: | 2.4357 |
| logD: | 2.4357 |
| logSw: | -2.7638 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.271 |
| InChI Key: | KKTJLUWIJNRVAT-UHFFFAOYSA-N |