3-chloro-N-{3-nitro-5-[(pyridin-3-yl)oxy]phenyl}-5-(thiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Chemical Structure Depiction of
3-chloro-N-{3-nitro-5-[(pyridin-3-yl)oxy]phenyl}-5-(thiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
3-chloro-N-{3-nitro-5-[(pyridin-3-yl)oxy]phenyl}-5-(thiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Compound characteristics
| Compound ID: | K061-0255 |
| Compound Name: | 3-chloro-N-{3-nitro-5-[(pyridin-3-yl)oxy]phenyl}-5-(thiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide |
| Molecular Weight: | 560.9 |
| Molecular Formula: | C23 H12 Cl F3 N6 O4 S |
| Smiles: | c1cc(cnc1)Oc1cc(cc(c1)[N+]([O-])=O)NC(c1c(c2nc(cc(C(F)(F)F)n2n1)c1cccs1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.8319 |
| logD: | 5.8102 |
| logSw: | -6.1851 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 93.471 |
| InChI Key: | ICJSXURHPPTEIO-UHFFFAOYSA-N |