3-chloro-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Chemical Structure Depiction of
3-chloro-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
3-chloro-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Compound characteristics
| Compound ID: | 1890-0098 |
| Compound Name: | 3-chloro-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide |
| Molecular Weight: | 501.92 |
| Molecular Formula: | C23 H15 Cl F3 N5 O S |
| Smiles: | C1CCc2c(C1)c(C#N)c(NC(c1c(c3nc(cc(C(F)(F)F)n3n1)c1ccccc1)[Cl])=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 6.1355 |
| logD: | 3.5792 |
| logSw: | -6.5862 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.577 |
| InChI Key: | JKIHTAARLIYAKY-UHFFFAOYSA-N |