N-(4-bromophenyl)-2-[3-(4-fluorophenyl)-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl]acetamide
Chemical Structure Depiction of
N-(4-bromophenyl)-2-[3-(4-fluorophenyl)-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl]acetamide
N-(4-bromophenyl)-2-[3-(4-fluorophenyl)-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl]acetamide
Compound characteristics
| Compound ID: | C656-0406 |
| Compound Name: | N-(4-bromophenyl)-2-[3-(4-fluorophenyl)-7-oxo-3,7-dihydro-6H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl]acetamide |
| Molecular Weight: | 443.23 |
| Molecular Formula: | C18 H12 Br F N6 O2 |
| Smiles: | C(C(Nc1ccc(cc1)[Br])=O)N1C=Nc2c(C1=O)nnn2c1ccc(cc1)F |
| Stereo: | ACHIRAL |
| logP: | 2.7562 |
| logD: | 2.7561 |
| logSw: | -3.0834 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.308 |
| InChI Key: | MRYRMXUMIOCOHT-UHFFFAOYSA-N |