propan-2-yl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-1H-1,2,3-triazole-4-carboxylate
Chemical Structure Depiction of
propan-2-yl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-1H-1,2,3-triazole-4-carboxylate
propan-2-yl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-1H-1,2,3-triazole-4-carboxylate
Compound characteristics
| Compound ID: | 8009-9646 |
| Compound Name: | propan-2-yl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-1H-1,2,3-triazole-4-carboxylate |
| Molecular Weight: | 430.44 |
| Molecular Formula: | C19 H23 F N8 O3 |
| Smiles: | CC(C)OC(c1c(CN2CCN(CC2)c2ccc(cc2)F)n(c2c(N)non2)nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.105 |
| logD: | 2.0384 |
| logSw: | -2.4753 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 110.265 |
| InChI Key: | NNVCSQQHEKVIHX-UHFFFAOYSA-N |