4-{[(2,5-dimethylphenyl)methyl]sulfanyl}-7-(4-ethoxyphenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidine
Chemical Structure Depiction of
4-{[(2,5-dimethylphenyl)methyl]sulfanyl}-7-(4-ethoxyphenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidine
4-{[(2,5-dimethylphenyl)methyl]sulfanyl}-7-(4-ethoxyphenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidine
Compound characteristics
| Compound ID: | C074-0127 |
| Compound Name: | 4-{[(2,5-dimethylphenyl)methyl]sulfanyl}-7-(4-ethoxyphenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidine |
| Molecular Weight: | 465.62 |
| Molecular Formula: | C29 H27 N3 O S |
| Smiles: | CCOc1ccc(cc1)n1cc(c2ccccc2)c2c(ncnc12)SCc1cc(C)ccc1C |
| Stereo: | ACHIRAL |
| logP: | 7.9081 |
| logD: | 7.9078 |
| logSw: | -5.9985 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 29.8104 |
| InChI Key: | KEJLFKFXGPPPCZ-UHFFFAOYSA-N |