1-{5-phenyl-7-[3-(trifluoromethyl)phenyl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl}piperidine-4-carboxamide
Chemical Structure Depiction of
1-{5-phenyl-7-[3-(trifluoromethyl)phenyl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl}piperidine-4-carboxamide
1-{5-phenyl-7-[3-(trifluoromethyl)phenyl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl}piperidine-4-carboxamide
Compound characteristics
| Compound ID: | K405-0877 |
| Compound Name: | 1-{5-phenyl-7-[3-(trifluoromethyl)phenyl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl}piperidine-4-carboxamide |
| Molecular Weight: | 465.48 |
| Molecular Formula: | C25 H22 F3 N5 O |
| Smiles: | C1CN(CCC1C(N)=O)c1c2c(cn(c3cccc(c3)C(F)(F)F)c2ncn1)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.8564 |
| logD: | 4.4444 |
| logSw: | -4.9572 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 60.271 |
| InChI Key: | XMBYJBFKQITXES-UHFFFAOYSA-N |