4-[2-{[(2,5-dimethylphenyl)methyl]sulfanyl}-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]-N-(2-phenylethyl)butanamide
Chemical Structure Depiction of
4-[2-{[(2,5-dimethylphenyl)methyl]sulfanyl}-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]-N-(2-phenylethyl)butanamide
4-[2-{[(2,5-dimethylphenyl)methyl]sulfanyl}-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]-N-(2-phenylethyl)butanamide
Compound characteristics
| Compound ID: | K292-1311 |
| Compound Name: | 4-[2-{[(2,5-dimethylphenyl)methyl]sulfanyl}-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]-N-(2-phenylethyl)butanamide |
| Molecular Weight: | 491.67 |
| Molecular Formula: | C27 H29 N3 O2 S2 |
| Smiles: | Cc1ccc(C)c(CSC2=Nc3ccsc3C(N2CCCC(NCCc2ccccc2)=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.8805 |
| logD: | 4.8805 |
| logSw: | -4.4927 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.081 |
| InChI Key: | WWODBCGONCRAMT-UHFFFAOYSA-N |