5-(4-bromophenyl)-N-{3-[(2,3-dihydro-1H-inden-5-yl)oxy]-5-nitrophenyl}-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
Chemical Structure Depiction of
5-(4-bromophenyl)-N-{3-[(2,3-dihydro-1H-inden-5-yl)oxy]-5-nitrophenyl}-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
5-(4-bromophenyl)-N-{3-[(2,3-dihydro-1H-inden-5-yl)oxy]-5-nitrophenyl}-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
Compound characteristics
| Compound ID: | K061-0854 |
| Compound Name: | 5-(4-bromophenyl)-N-{3-[(2,3-dihydro-1H-inden-5-yl)oxy]-5-nitrophenyl}-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide |
| Molecular Weight: | 638.4 |
| Molecular Formula: | C29 H19 Br F3 N5 O4 |
| Smiles: | C1Cc2ccc(cc2C1)Oc1cc(cc(c1)[N+]([O-])=O)NC(c1cnn2c(cc(c3ccc(cc3)[Br])nc12)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 8.3491 |
| logD: | 8.3377 |
| logSw: | -6.1096 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.675 |
| InChI Key: | MDZGFSVMARIPPO-UHFFFAOYSA-N |