2-[2-(4-butylanilino)-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-butylanilino)-2-oxoethyl]-N-[(4-methylphenyl)methyl]-3-oxo-2,3-dihydro[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
2-[2-(4-butylanilino)-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: | L861-0679 |
| Compound Name: | 2-[2-(4-butylanilino)-2-oxoethyl]-N-[(4-methylphenyl)methyl]-3-oxo-2,3-dihydro[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide |
| Molecular Weight: | 471.56 |
| Molecular Formula: | C27 H29 N5 O3 |
| Smiles: | CCCCc1ccc(cc1)NC(CN1C(N2C=C(C=CC2=N1)C(NCc1ccc(C)cc1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7008 |
| logD: | 4.7 |
| logSw: | -4.3041 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.362 |
| InChI Key: | RAOIKEJGTTUXCO-UHFFFAOYSA-N |