2,2-dimethyl-N-{[4-(3-methyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]methyl}propanamide
Chemical Structure Depiction of
2,2-dimethyl-N-{[4-(3-methyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]methyl}propanamide
2,2-dimethyl-N-{[4-(3-methyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]methyl}propanamide
Compound characteristics
| Compound ID: | J011-0221 |
| Compound Name: | 2,2-dimethyl-N-{[4-(3-methyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]methyl}propanamide |
| Molecular Weight: | 329.42 |
| Molecular Formula: | C16 H19 N5 O S |
| Smiles: | Cc1nnc2n1nc(c1ccc(CNC(C(C)(C)C)=O)cc1)s2 |
| Stereo: | ACHIRAL |
| logP: | 1.8854 |
| logD: | 1.8854 |
| logSw: | -2.4314 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.455 |
| InChI Key: | QTTAPLJBSIUCRD-UHFFFAOYSA-N |