ethyl 1-{[6-(4-methoxyphenyl)-3,5-dioxo-6,7-dihydro-3H-imidazo[5,1-c][1,2,4]triazol-2(5H)-yl]acetyl}piperidine-4-carboxylate
Chemical Structure Depiction of
ethyl 1-{[6-(4-methoxyphenyl)-3,5-dioxo-6,7-dihydro-3H-imidazo[5,1-c][1,2,4]triazol-2(5H)-yl]acetyl}piperidine-4-carboxylate
ethyl 1-{[6-(4-methoxyphenyl)-3,5-dioxo-6,7-dihydro-3H-imidazo[5,1-c][1,2,4]triazol-2(5H)-yl]acetyl}piperidine-4-carboxylate
Compound characteristics
| Compound ID: | 8020-3780 |
| Compound Name: | ethyl 1-{[6-(4-methoxyphenyl)-3,5-dioxo-6,7-dihydro-3H-imidazo[5,1-c][1,2,4]triazol-2(5H)-yl]acetyl}piperidine-4-carboxylate |
| Molecular Weight: | 443.46 |
| Molecular Formula: | C21 H25 N5 O6 |
| Smiles: | CCOC(C1CCN(CC1)C(CN1C(N2C(CN(C2=O)c2ccc(cc2)OC)=N1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.0642 |
| logD: | 1.0642 |
| logSw: | -2.0079 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 93.845 |
| InChI Key: | YQICLNJTCYWOHA-UHFFFAOYSA-N |