5-(4-bromophenyl)-N-{3-[(2,3-dihydro-1H-inden-5-yl)oxy]-5-nitrophenyl}-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-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-2-carboxamide
5-(4-bromophenyl)-N-{3-[(2,3-dihydro-1H-inden-5-yl)oxy]-5-nitrophenyl}-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Compound characteristics
| Compound ID: | K061-0807 |
| Compound Name: | 5-(4-bromophenyl)-N-{3-[(2,3-dihydro-1H-inden-5-yl)oxy]-5-nitrophenyl}-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide |
| Molecular Weight: | 638.4 |
| Molecular Formula: | C29 H19 Br F3 N5 O4 |
| Smiles: | C1Cc2ccc(cc2C1)Oc1cc(cc(c1)[N+]([O-])=O)NC(c1cc2nc(cc(C(F)(F)F)n2n1)c1ccc(cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 8.4839 |
| logD: | 8.4814 |
| logSw: | -6.2425 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.905 |
| InChI Key: | KXNWNCZSVHLKJI-UHFFFAOYSA-N |