ethyl 4-[7-(3-chlorophenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]piperazine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-[7-(3-chlorophenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]piperazine-1-carboxylate
ethyl 4-[7-(3-chlorophenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]piperazine-1-carboxylate
Compound characteristics
Compound ID: | K405-0732 |
Compound Name: | ethyl 4-[7-(3-chlorophenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]piperazine-1-carboxylate |
Molecular Weight: | 461.95 |
Molecular Formula: | C25 H24 Cl N5 O2 |
Smiles: | CCOC(N1CCN(CC1)c1c2c(cn(c3cccc(c3)[Cl])c2ncn1)c1ccccc1)=O |
Stereo: | ACHIRAL |
logP: | 5.7974 |
logD: | 5.6896 |
logSw: | -5.944 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 48.992 |
InChI Key: | LLSYAWWRIDBSMX-UHFFFAOYSA-N |