3-bromo-N-(3-carbamoyl-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-bromo-N-(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-(thiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
3-bromo-N-(3-carbamoyl-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: | Y500-0537 |
| Compound Name: | 3-bromo-N-(3-carbamoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-5-(thiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide |
| Molecular Weight: | 570.41 |
| Molecular Formula: | C21 H15 Br F3 N5 O2 S2 |
| Smiles: | C1CCc2c(C1)c(C(N)=O)c(NC(c1c(c3nc(cc(C(F)(F)F)n3n1)c1cccs1)[Br])=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 4.251 |
| logD: | 2.7236 |
| logSw: | -4.6084 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 77.598 |
| InChI Key: | QQBGGRGTRVVXSL-UHFFFAOYSA-N |