methyl 5-(chloromethyl)-7-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidine-3-carboxylate
Chemical Structure Depiction of
methyl 5-(chloromethyl)-7-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidine-3-carboxylate
methyl 5-(chloromethyl)-7-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidine-3-carboxylate
Compound characteristics
| Compound ID: | 8019-4474 |
| Compound Name: | methyl 5-(chloromethyl)-7-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidine-3-carboxylate |
| Molecular Weight: | 241.63 |
| Molecular Formula: | C9 H8 Cl N3 O3 |
| Smiles: | COC(c1cnn2C(CC(C[Cl])=Nc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.5806 |
| logD: | 0.4164 |
| logSw: | -1.1152 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.09 |
| InChI Key: | RBONPUOKAWZDGV-UHFFFAOYSA-N |