ethyl 4-({3-[(4-fluorophenyl)methyl]-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl}acetyl)piperazine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-({3-[(4-fluorophenyl)methyl]-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl}acetyl)piperazine-1-carboxylate
ethyl 4-({3-[(4-fluorophenyl)methyl]-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl}acetyl)piperazine-1-carboxylate
Compound characteristics
| Compound ID: | C656-0092 |
| Compound Name: | ethyl 4-({3-[(4-fluorophenyl)methyl]-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl}acetyl)piperazine-1-carboxylate |
| Molecular Weight: | 443.44 |
| Molecular Formula: | C20 H22 F N7 O4 |
| Smiles: | CCOC(N1CCN(CC1)C(CN1C=Nc2c(C1=O)nnn2Cc1ccc(cc1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.3024 |
| logD: | 0.3023 |
| logSw: | -1.6438 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 92.195 |
| InChI Key: | CBFOWXZGGUIJDA-UHFFFAOYSA-N |