7-tert-butyl-2-methyl-3-phenylpyrazolo[1,5-a]pyrimidine-5-carboxylic acid
Chemical Structure Depiction of
7-tert-butyl-2-methyl-3-phenylpyrazolo[1,5-a]pyrimidine-5-carboxylic acid
7-tert-butyl-2-methyl-3-phenylpyrazolo[1,5-a]pyrimidine-5-carboxylic acid
Compound characteristics
| Compound ID: | D724-1048 |
| Compound Name: | 7-tert-butyl-2-methyl-3-phenylpyrazolo[1,5-a]pyrimidine-5-carboxylic acid |
| Molecular Weight: | 309.37 |
| Molecular Formula: | C18 H19 N3 O2 |
| Smiles: | Cc1c(c2ccccc2)c2nc(cc(C(C)(C)C)n2n1)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4933 |
| logD: | -0.9328 |
| logSw: | -3.9038 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.929 |
| InChI Key: | YXFLGSIULFLCCX-UHFFFAOYSA-N |