N-(3-butyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)adamantane-1-carboxamide
Chemical Structure Depiction of
N-(3-butyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)adamantane-1-carboxamide
N-(3-butyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)adamantane-1-carboxamide
Compound characteristics
| Compound ID: | G952-0636 |
| Compound Name: | N-(3-butyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)adamantane-1-carboxamide |
| Molecular Weight: | 359.49 |
| Molecular Formula: | C18 H25 N5 O S |
| Smiles: | CCCCc1nnc2n1nc(NC(C13CC4CC(CC(C4)C3)C1)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 4.5195 |
| logD: | 4.3548 |
| logSw: | -4.1511 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.406 |
| InChI Key: | VTVDYXPOZVBJSX-UHFFFAOYSA-N |