ethyl 1-{5-phenyl-7-[3-(trifluoromethyl)phenyl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl}piperidine-4-carboxylate
Chemical Structure Depiction of
ethyl 1-{5-phenyl-7-[3-(trifluoromethyl)phenyl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl}piperidine-4-carboxylate
ethyl 1-{5-phenyl-7-[3-(trifluoromethyl)phenyl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl}piperidine-4-carboxylate
Compound characteristics
| Compound ID: | K405-0876 |
| Compound Name: | ethyl 1-{5-phenyl-7-[3-(trifluoromethyl)phenyl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl}piperidine-4-carboxylate |
| Molecular Weight: | 494.52 |
| Molecular Formula: | C27 H25 F3 N4 O2 |
| Smiles: | CCOC(C1CCN(CC1)c1c2c(cn(c3cccc(c3)C(F)(F)F)c2ncn1)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.3893 |
| logD: | 5.9773 |
| logSw: | -5.8086 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 46.966 |
| InChI Key: | DEJJZJZXNMDDLV-UHFFFAOYSA-N |