ethyl 5-(4-methylphenyl)-1-[4-(1H-pyrrol-1-yl)-1,2,5-oxadiazol-3-yl]-1H-1,2,3-triazole-4-carboxylate
Chemical Structure Depiction of
ethyl 5-(4-methylphenyl)-1-[4-(1H-pyrrol-1-yl)-1,2,5-oxadiazol-3-yl]-1H-1,2,3-triazole-4-carboxylate
ethyl 5-(4-methylphenyl)-1-[4-(1H-pyrrol-1-yl)-1,2,5-oxadiazol-3-yl]-1H-1,2,3-triazole-4-carboxylate
Compound characteristics
| Compound ID: | 8015-0409 |
| Compound Name: | ethyl 5-(4-methylphenyl)-1-[4-(1H-pyrrol-1-yl)-1,2,5-oxadiazol-3-yl]-1H-1,2,3-triazole-4-carboxylate |
| Molecular Weight: | 364.36 |
| Molecular Formula: | C18 H16 N6 O3 |
| Smiles: | CCOC(c1c(c2ccc(C)cc2)n(c2c(non2)n2cccc2)nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1196 |
| logD: | 4.1196 |
| logSw: | -4.0333 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 86.063 |
| InChI Key: | DGMCMMWMQVSSRA-UHFFFAOYSA-N |