methyl 4-(4-bromo-2-fluoroanilino)[1,2]oxazolo[5,4-d]pyrimidine-3-carboxylate
Chemical Structure Depiction of
methyl 4-(4-bromo-2-fluoroanilino)[1,2]oxazolo[5,4-d]pyrimidine-3-carboxylate
methyl 4-(4-bromo-2-fluoroanilino)[1,2]oxazolo[5,4-d]pyrimidine-3-carboxylate
Compound characteristics
| Compound ID: | C066-4881 |
| Compound Name: | methyl 4-(4-bromo-2-fluoroanilino)[1,2]oxazolo[5,4-d]pyrimidine-3-carboxylate |
| Molecular Weight: | 367.13 |
| Molecular Formula: | C13 H8 Br F N4 O3 |
| Smiles: | COC(c1c2c(Nc3ccc(cc3F)[Br])ncnc2on1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2586 |
| logD: | 3.2586 |
| logSw: | -3.7728 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.449 |
| InChI Key: | SMIMATVEMRLQRV-UHFFFAOYSA-N |