N-benzyl-3-oxo-2-{2-oxo-2-[4-(propan-2-yl)anilino]ethyl}-2,3-dihydro[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
Chemical Structure Depiction of
N-benzyl-3-oxo-2-{2-oxo-2-[4-(propan-2-yl)anilino]ethyl}-2,3-dihydro[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
N-benzyl-3-oxo-2-{2-oxo-2-[4-(propan-2-yl)anilino]ethyl}-2,3-dihydro[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
Compound characteristics
| Compound ID: | L861-0434 |
| Compound Name: | N-benzyl-3-oxo-2-{2-oxo-2-[4-(propan-2-yl)anilino]ethyl}-2,3-dihydro[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide |
| Molecular Weight: | 443.5 |
| Molecular Formula: | C25 H25 N5 O3 |
| Smiles: | CC(C)c1ccc(cc1)NC(CN1C(N2C=C(C=CC2=N1)C(NCc1ccccc1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6464 |
| logD: | 3.6456 |
| logSw: | -3.8201 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.362 |
| InChI Key: | BTCVESQCPLQVLR-UHFFFAOYSA-N |