ethyl (3-cyano-5-methyl-7-oxo-4,7-dihydropyrazolo[1,5-a]pyrimidin-6-yl)acetate
Chemical Structure Depiction of
ethyl (3-cyano-5-methyl-7-oxo-4,7-dihydropyrazolo[1,5-a]pyrimidin-6-yl)acetate
ethyl (3-cyano-5-methyl-7-oxo-4,7-dihydropyrazolo[1,5-a]pyrimidin-6-yl)acetate
Compound characteristics
| Compound ID: | 5638-0143 |
| Compound Name: | ethyl (3-cyano-5-methyl-7-oxo-4,7-dihydropyrazolo[1,5-a]pyrimidin-6-yl)acetate |
| Molecular Weight: | 260.25 |
| Molecular Formula: | C12 H12 N4 O3 |
| Smiles: | CCOC(CC1=C(C)Nc2c(C#N)cnn2C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.7358 |
| logD: | -0.106 |
| logSw: | -1.7826 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.853 |
| InChI Key: | KVIHYDREXLDGNL-UHFFFAOYSA-N |