N-benzyl-3-{[2-oxo-2-(2,4,6-trimethylanilino)ethyl]sulfanyl}[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
Chemical Structure Depiction of
N-benzyl-3-{[2-oxo-2-(2,4,6-trimethylanilino)ethyl]sulfanyl}[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
N-benzyl-3-{[2-oxo-2-(2,4,6-trimethylanilino)ethyl]sulfanyl}[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
Compound characteristics
| Compound ID: | L860-0414 |
| Compound Name: | N-benzyl-3-{[2-oxo-2-(2,4,6-trimethylanilino)ethyl]sulfanyl}[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide |
| Molecular Weight: | 459.57 |
| Molecular Formula: | C25 H25 N5 O2 S |
| Smiles: | Cc1cc(C)c(c(C)c1)NC(CSc1nnc2ccc(cn12)C(NCc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5391 |
| logD: | 3.5391 |
| logSw: | -3.636 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.219 |
| InChI Key: | NTUROGPIKQRMAW-UHFFFAOYSA-N |