1-(4-{4-[7-(3-chloro-4-methylphenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]piperazin-1-yl}phenyl)ethan-1-one
Chemical Structure Depiction of
1-(4-{4-[7-(3-chloro-4-methylphenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]piperazin-1-yl}phenyl)ethan-1-one
1-(4-{4-[7-(3-chloro-4-methylphenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]piperazin-1-yl}phenyl)ethan-1-one
Compound characteristics
| Compound ID: | K405-0711 |
| Compound Name: | 1-(4-{4-[7-(3-chloro-4-methylphenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]piperazin-1-yl}phenyl)ethan-1-one |
| Molecular Weight: | 522.05 |
| Molecular Formula: | C31 H28 Cl N5 O |
| Smiles: | CC(c1ccc(cc1)N1CCN(CC1)c1c2c(cn(c3ccc(C)c(c3)[Cl])c2ncn1)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 7.1739 |
| logD: | 7.0661 |
| logSw: | -6.2772 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 43.299 |
| InChI Key: | YZSCKYUWHFQLKF-UHFFFAOYSA-N |