ethyl 2-{[7-(4-ethoxyphenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]sulfanyl}propanoate
Chemical Structure Depiction of
ethyl 2-{[7-(4-ethoxyphenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]sulfanyl}propanoate
ethyl 2-{[7-(4-ethoxyphenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]sulfanyl}propanoate
Compound characteristics
| Compound ID: | C074-0129 |
| Compound Name: | ethyl 2-{[7-(4-ethoxyphenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl]sulfanyl}propanoate |
| Molecular Weight: | 447.56 |
| Molecular Formula: | C25 H25 N3 O3 S |
| Smiles: | CCOC(C(C)Sc1c2c(cn(c3ccc(cc3)OCC)c2ncn1)c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.8832 |
| logD: | 5.8832 |
| logSw: | -5.7311 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.836 |
| InChI Key: | LXPOJEAKUGCFTC-KRWDZBQOSA-N |