3-chloro-N-{3-[(2,3-dihydro-1H-inden-5-yl)oxy]-5-nitrophenyl}-5-(thiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Chemical Structure Depiction of
3-chloro-N-{3-[(2,3-dihydro-1H-inden-5-yl)oxy]-5-nitrophenyl}-5-(thiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
3-chloro-N-{3-[(2,3-dihydro-1H-inden-5-yl)oxy]-5-nitrophenyl}-5-(thiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Compound characteristics
| Compound ID: | K061-0263 |
| Compound Name: | 3-chloro-N-{3-[(2,3-dihydro-1H-inden-5-yl)oxy]-5-nitrophenyl}-5-(thiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide |
| Molecular Weight: | 599.97 |
| Molecular Formula: | C27 H17 Cl F3 N5 O4 S |
| Smiles: | C1Cc2ccc(cc2C1)Oc1cc(cc(c1)[N+]([O-])=O)NC(c1c(c2nc(cc(C(F)(F)F)n2n1)c1cccs1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 7.8692 |
| logD: | 7.8476 |
| logSw: | -6.7757 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.24 |
| InChI Key: | FTZAPTNWXAMUGB-UHFFFAOYSA-N |