N-(3-methylphenyl)-3-oxo-2-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-2,3-dihydro[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
Chemical Structure Depiction of
N-(3-methylphenyl)-3-oxo-2-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-2,3-dihydro[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
N-(3-methylphenyl)-3-oxo-2-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-2,3-dihydro[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
Compound characteristics
| Compound ID: | L861-0272 |
| Compound Name: | N-(3-methylphenyl)-3-oxo-2-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]-2,3-dihydro[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide |
| Molecular Weight: | 470.53 |
| Molecular Formula: | C26 H26 N6 O3 |
| Smiles: | Cc1cccc(c1)NC(C1C=CC2=NN(CC(N3CCN(CC3)c3ccccc3)=O)C(N2C=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5912 |
| logD: | 2.5894 |
| logSw: | -3.0097 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.544 |
| InChI Key: | MMHBMWUMLOXHPK-UHFFFAOYSA-N |