N'-[(4-bromobenzoyl)oxy]-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboximidamide
Chemical Structure Depiction of
N'-[(4-bromobenzoyl)oxy]-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboximidamide
N'-[(4-bromobenzoyl)oxy]-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboximidamide
Compound characteristics
Compound ID: | Y501-2476 |
Compound Name: | N'-[(4-bromobenzoyl)oxy]-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboximidamide |
Molecular Weight: | 428.17 |
Molecular Formula: | C15 H9 Br F3 N5 O2 |
Smiles: | c1cc(ccc1C(=O)O/N=C(/c1cnn2c(ccnc12)C(F)(F)F)N)[Br] |
Stereo: | ACHIRAL |
logP: | 2.8038 |
logD: | 2.8037 |
logSw: | -3.3265 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 71.743 |
InChI Key: | IFOAGQUJNOYTQM-UHFFFAOYSA-N |