2-{[7-(3-fluorophenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]sulfanyl}-1-phenylethan-1-one
Chemical Structure Depiction of
2-{[7-(3-fluorophenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]sulfanyl}-1-phenylethan-1-one
2-{[7-(3-fluorophenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]sulfanyl}-1-phenylethan-1-one
Compound characteristics
| Compound ID: | C074-0056 |
| Compound Name: | 2-{[7-(3-fluorophenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]sulfanyl}-1-phenylethan-1-one |
| Molecular Weight: | 439.51 |
| Molecular Formula: | C26 H18 F N3 O S |
| Smiles: | C(C(c1ccccc1)=O)Sc1c2c(cn(c3cccc(c3)F)c2ncn1)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.7764 |
| logD: | 5.7764 |
| logSw: | -6.0945 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 35.934 |
| InChI Key: | OPSMNCYTKOTBOS-UHFFFAOYSA-N |