N-(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Chemical Structure Depiction of
N-(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
N-(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Compound characteristics
| Compound ID: | Y500-0842 |
| Compound Name: | N-(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide |
| Molecular Weight: | 485.49 |
| Molecular Formula: | C23 H18 F3 N5 O2 S |
| Smiles: | C1CCc2c(C1)c(C(N)=O)c(NC(c1cc3nc(cc(C(F)(F)F)n3n1)c1ccccc1)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 3.8775 |
| logD: | 3.2001 |
| logSw: | -4.4377 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 75.263 |
| InChI Key: | QBTHNMQQPMTCCK-UHFFFAOYSA-N |