N-{3-[(4-methylphenoxy)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl}pentanamide
Chemical Structure Depiction of
N-{3-[(4-methylphenoxy)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl}pentanamide
N-{3-[(4-methylphenoxy)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl}pentanamide
Compound characteristics
| Compound ID: | E157-4277 |
| Compound Name: | N-{3-[(4-methylphenoxy)methyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl}pentanamide |
| Molecular Weight: | 345.42 |
| Molecular Formula: | C16 H19 N5 O2 S |
| Smiles: | CCCCC(Nc1nn2c(COc3ccc(C)cc3)nnc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7332 |
| logD: | 2.7085 |
| logSw: | -3.1484 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.659 |
| InChI Key: | BWHFWJAXHKFRSD-UHFFFAOYSA-N |