3-chloro-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-(thiophen-2-yl)-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-(thiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
3-chloro-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-(thiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Compound characteristics
| Compound ID: | K061-0257 |
| Compound Name: | 3-chloro-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-(thiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide |
| Molecular Weight: | 507.94 |
| Molecular Formula: | C21 H13 Cl F3 N5 O S2 |
| Smiles: | C1CCc2c(C1)c(C#N)c(NC(c1c(c3nc(cc(C(F)(F)F)n3n1)c1cccs1)[Cl])=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 5.8846 |
| logD: | 3.3284 |
| logSw: | -6.4666 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.595 |
| InChI Key: | LZGUCCWQDOHAIL-UHFFFAOYSA-N |