4-{[(2,5-dimethylphenyl)methyl]sulfanyl}-7-(4-methoxyphenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidine
Chemical Structure Depiction of
4-{[(2,5-dimethylphenyl)methyl]sulfanyl}-7-(4-methoxyphenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidine
4-{[(2,5-dimethylphenyl)methyl]sulfanyl}-7-(4-methoxyphenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidine
Compound characteristics
| Compound ID: | C074-0099 |
| Compound Name: | 4-{[(2,5-dimethylphenyl)methyl]sulfanyl}-7-(4-methoxyphenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidine |
| Molecular Weight: | 451.59 |
| Molecular Formula: | C28 H25 N3 O S |
| Smiles: | Cc1ccc(C)c(CSc2c3c(cn(c4ccc(cc4)OC)c3ncn2)c2ccccc2)c1 |
| Stereo: | ACHIRAL |
| logP: | 7.5215 |
| logD: | 7.5212 |
| logSw: | -6.0237 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 30.2305 |
| InChI Key: | CKVPNRQCJIAZQX-UHFFFAOYSA-N |