2-[2-(4-acetylanilino)-2-oxoethyl]-N-[(4-methylphenyl)methyl]-3-oxo-2,3-dihydro[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
Chemical Structure Depiction of
2-[2-(4-acetylanilino)-2-oxoethyl]-N-[(4-methylphenyl)methyl]-3-oxo-2,3-dihydro[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
2-[2-(4-acetylanilino)-2-oxoethyl]-N-[(4-methylphenyl)methyl]-3-oxo-2,3-dihydro[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
Compound characteristics
| Compound ID: | L861-0604 |
| Compound Name: | 2-[2-(4-acetylanilino)-2-oxoethyl]-N-[(4-methylphenyl)methyl]-3-oxo-2,3-dihydro[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide |
| Molecular Weight: | 457.49 |
| Molecular Formula: | C25 H23 N5 O4 |
| Smiles: | CC(c1ccc(cc1)NC(CN1C(N2C=C(C=CC2=N1)C(NCc1ccc(C)cc1)=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2737 |
| logD: | 2.2728 |
| logSw: | -2.7989 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 94.189 |
| InChI Key: | NRQCKYNGQFECDI-UHFFFAOYSA-N |