methyl 4-[(2-methyl-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl)methyl]benzoate
Chemical Structure Depiction of
methyl 4-[(2-methyl-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl)methyl]benzoate
methyl 4-[(2-methyl-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl)methyl]benzoate
Compound characteristics
| Compound ID: | C798-0728 |
| Compound Name: | methyl 4-[(2-methyl-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4(5H)-yl)methyl]benzoate |
| Molecular Weight: | 299.33 |
| Molecular Formula: | C16 H17 N3 O3 |
| Smiles: | Cc1cc2N(Cc3ccc(cc3)C(=O)OC)C(CCn2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.002 |
| logD: | 2.002 |
| logSw: | -2.304 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.272 |
| InChI Key: | FEXZZRKPKSNHRY-UHFFFAOYSA-N |