rel-(5R,7S)-N-[(adamantan-1-yl)methyl]-3-chloro-5-(furan-2-yl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide
Chemical Structure Depiction of
rel-(5R,7S)-N-[(adamantan-1-yl)methyl]-3-chloro-5-(furan-2-yl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide
rel-(5R,7S)-N-[(adamantan-1-yl)methyl]-3-chloro-5-(furan-2-yl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide
Compound characteristics
| Compound ID: | 8013-3967 |
| Compound Name: | rel-(5R,7S)-N-[(adamantan-1-yl)methyl]-3-chloro-5-(furan-2-yl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide |
| Molecular Weight: | 482.93 |
| Molecular Formula: | C23 H26 Cl F3 N4 O2 |
| Smiles: | C1C2CC3CC1CC(C2)(C3)CNC(c1c(c2N[C@H](C[C@@H](C(F)(F)F)n2n1)c1ccco1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 5.5835 |
| logD: | 5.5835 |
| logSw: | -5.8986 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.086 |
| InChI Key: | ZDWRHOKEIRJQTH-ILDINJLVSA-N |