4-butoxy-N-[2-methyl-5-(3-methyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]benzamide
Chemical Structure Depiction of
4-butoxy-N-[2-methyl-5-(3-methyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]benzamide
4-butoxy-N-[2-methyl-5-(3-methyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]benzamide
Compound characteristics
| Compound ID: | 6979-0596 |
| Compound Name: | 4-butoxy-N-[2-methyl-5-(3-methyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]benzamide |
| Molecular Weight: | 421.52 |
| Molecular Formula: | C22 H23 N5 O2 S |
| Smiles: | CCCCOc1ccc(cc1)C(Nc1cc(ccc1C)c1nn2c(C)nnc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1978 |
| logD: | 4.1978 |
| logSw: | -4.1056 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.581 |
| InChI Key: | HEFOQVJTCGYFGC-UHFFFAOYSA-N |