ethyl 2-{[7-(3-fluorophenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]sulfanyl}butanoate
Chemical Structure Depiction of
ethyl 2-{[7-(3-fluorophenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]sulfanyl}butanoate
ethyl 2-{[7-(3-fluorophenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]sulfanyl}butanoate
Compound characteristics
| Compound ID: | C074-0046 |
| Compound Name: | ethyl 2-{[7-(3-fluorophenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]sulfanyl}butanoate |
| Molecular Weight: | 435.52 |
| Molecular Formula: | C24 H22 F N3 O2 S |
| Smiles: | CCC(C(=O)OCC)Sc1c2c(cn(c3cccc(c3)F)c2ncn1)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.0576 |
| logD: | 6.0576 |
| logSw: | -5.7252 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 43.712 |
| InChI Key: | CEZLQFJMEAELHI-FQEVSTJZSA-N |