7-(chloromethyl)-5-oxo-4,5-dihydropyrazolo[1,5-a]pyrimidine-2-carboxylic acid
Chemical Structure Depiction of
7-(chloromethyl)-5-oxo-4,5-dihydropyrazolo[1,5-a]pyrimidine-2-carboxylic acid
7-(chloromethyl)-5-oxo-4,5-dihydropyrazolo[1,5-a]pyrimidine-2-carboxylic acid
Compound characteristics
| Compound ID: | Y504-8694 |
| Compound Name: | 7-(chloromethyl)-5-oxo-4,5-dihydropyrazolo[1,5-a]pyrimidine-2-carboxylic acid |
| Molecular Weight: | 227.6 |
| Molecular Formula: | C8 H6 Cl N3 O3 |
| Smiles: | C(C1=CC(Nc2cc(C(O)=O)nn12)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 0.2205 |
| logD: | -2.0483 |
| logSw: | -1.6767 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.775 |
| InChI Key: | WJXYANQIRGFTJR-UHFFFAOYSA-N |