ethyl 2-{[7-(4-fluorophenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]sulfanyl}propanoate
Chemical Structure Depiction of
ethyl 2-{[7-(4-fluorophenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]sulfanyl}propanoate
ethyl 2-{[7-(4-fluorophenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]sulfanyl}propanoate
Compound characteristics
| Compound ID: | C074-0017 |
| Compound Name: | ethyl 2-{[7-(4-fluorophenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]sulfanyl}propanoate |
| Molecular Weight: | 421.49 |
| Molecular Formula: | C23 H20 F N3 O2 S |
| Smiles: | CCOC(C(C)Sc1c2c(cn(c3ccc(cc3)F)c2ncn1)c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.5433 |
| logD: | 5.5433 |
| logSw: | -5.6199 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 43.712 |
| InChI Key: | ZXZLRQJBELRYEJ-HNNXBMFYSA-N |