N'-[(2-bromobenzoyl)oxy]-5-methyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboximidamide
Chemical Structure Depiction of
N'-[(2-bromobenzoyl)oxy]-5-methyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboximidamide
N'-[(2-bromobenzoyl)oxy]-5-methyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboximidamide
Compound characteristics
| Compound ID: | Y504-5037 |
| Compound Name: | N'-[(2-bromobenzoyl)oxy]-5-methyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboximidamide |
| Molecular Weight: | 442.19 |
| Molecular Formula: | C16 H11 Br F3 N5 O2 |
| Smiles: | Cc1cc(C(F)(F)F)n2c(c(cn2)\C(N)=N/OC(c2ccccc2[Br])=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.5539 |
| logD: | 2.5538 |
| logSw: | -2.8525 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.117 |
| InChI Key: | ULKNMONKXHSPLJ-UHFFFAOYSA-N |