ethyl 1-{2-[2-(3-methylanilino)-2-oxoethyl]-1-oxo-1,2-dihydro[1,2,4]triazolo[4,3-a]quinoxalin-4-yl}piperidine-4-carboxylate
Chemical Structure Depiction of
ethyl 1-{2-[2-(3-methylanilino)-2-oxoethyl]-1-oxo-1,2-dihydro[1,2,4]triazolo[4,3-a]quinoxalin-4-yl}piperidine-4-carboxylate
ethyl 1-{2-[2-(3-methylanilino)-2-oxoethyl]-1-oxo-1,2-dihydro[1,2,4]triazolo[4,3-a]quinoxalin-4-yl}piperidine-4-carboxylate
Compound characteristics
| Compound ID: | F844-1226 |
| Compound Name: | ethyl 1-{2-[2-(3-methylanilino)-2-oxoethyl]-1-oxo-1,2-dihydro[1,2,4]triazolo[4,3-a]quinoxalin-4-yl}piperidine-4-carboxylate |
| Molecular Weight: | 488.55 |
| Molecular Formula: | C26 H28 N6 O4 |
| Smiles: | CCOC(C1CCN(CC1)C1C2=NN(CC(Nc3cccc(C)c3)=O)C(N2c2ccccc2N=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3664 |
| logD: | 3.3664 |
| logSw: | -3.4444 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.662 |
| InChI Key: | YXPIVGXTJGRDLP-UHFFFAOYSA-N |