7-(4-ethoxyphenyl)-4-{[(4-methylphenyl)methyl]sulfanyl}-5-phenyl-7H-pyrrolo[2,3-d]pyrimidine
Chemical Structure Depiction of
7-(4-ethoxyphenyl)-4-{[(4-methylphenyl)methyl]sulfanyl}-5-phenyl-7H-pyrrolo[2,3-d]pyrimidine
7-(4-ethoxyphenyl)-4-{[(4-methylphenyl)methyl]sulfanyl}-5-phenyl-7H-pyrrolo[2,3-d]pyrimidine
Compound characteristics
Compound ID: | C074-0123 |
Compound Name: | 7-(4-ethoxyphenyl)-4-{[(4-methylphenyl)methyl]sulfanyl}-5-phenyl-7H-pyrrolo[2,3-d]pyrimidine |
Molecular Weight: | 451.59 |
Molecular Formula: | C28 H25 N3 O S |
Smiles: | CCOc1ccc(cc1)n1cc(c2ccccc2)c2c(ncnc12)SCc1ccc(C)cc1 |
Stereo: | ACHIRAL |
logP: | 6.8264 |
logD: | 6.8261 |
logSw: | -6.0754 |
Hydrogen bond acceptors count: | 4 |
Polar surface area: | 29.8104 |
InChI Key: | JBUJVXMBAIRDBU-UHFFFAOYSA-N |