methyl [3-(4-chlorophenyl)-2-methyl-7-oxo-4,7-dihydropyrazolo[1,5-a]pyrimidin-5-yl]acetate
Chemical Structure Depiction of
methyl [3-(4-chlorophenyl)-2-methyl-7-oxo-4,7-dihydropyrazolo[1,5-a]pyrimidin-5-yl]acetate
methyl [3-(4-chlorophenyl)-2-methyl-7-oxo-4,7-dihydropyrazolo[1,5-a]pyrimidin-5-yl]acetate
Compound characteristics
| Compound ID: | 8018-0889 |
| Compound Name: | methyl [3-(4-chlorophenyl)-2-methyl-7-oxo-4,7-dihydropyrazolo[1,5-a]pyrimidin-5-yl]acetate |
| Molecular Weight: | 331.76 |
| Molecular Formula: | C16 H14 Cl N3 O3 |
| Smiles: | Cc1c(c2ccc(cc2)[Cl])c2NC(CC(=O)OC)=CC(n2n1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1398 |
| logD: | 1.8841 |
| logSw: | -3.4451 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.387 |
| InChI Key: | UOOSIZUJFDPXTE-UHFFFAOYSA-N |