2-(3-methylphenoxy)-1-{4-[7-(2-methylphenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]piperazin-1-yl}ethan-1-one
Chemical Structure Depiction of
2-(3-methylphenoxy)-1-{4-[7-(2-methylphenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]piperazin-1-yl}ethan-1-one
2-(3-methylphenoxy)-1-{4-[7-(2-methylphenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]piperazin-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | D434-0278 |
| Compound Name: | 2-(3-methylphenoxy)-1-{4-[7-(2-methylphenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]piperazin-1-yl}ethan-1-one |
| Molecular Weight: | 517.63 |
| Molecular Formula: | C32 H31 N5 O2 |
| Smiles: | Cc1cccc(c1)OCC(N1CCN(CC1)c1c2c(cn(c3ccccc3C)c2ncn1)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0737 |
| logD: | 5.8176 |
| logSw: | -5.7876 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 49.339 |
| InChI Key: | WWQRWAAYHUHANA-UHFFFAOYSA-N |