4-{2-[(2-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-oxoethyl)sulfanyl]-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl}-N-(2-phenylethyl)butanamide
Chemical Structure Depiction of
4-{2-[(2-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-oxoethyl)sulfanyl]-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl}-N-(2-phenylethyl)butanamide
4-{2-[(2-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-oxoethyl)sulfanyl]-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl}-N-(2-phenylethyl)butanamide
Compound characteristics
| Compound ID: | K292-1291 |
| Compound Name: | 4-{2-[(2-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-oxoethyl)sulfanyl]-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl}-N-(2-phenylethyl)butanamide |
| Molecular Weight: | 594.75 |
| Molecular Formula: | C30 H34 N4 O5 S2 |
| Smiles: | COc1ccc(CCNC(CSC2=Nc3ccsc3C(N2CCCC(NCCc2ccccc2)=O)=O)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 2.024 |
| logD: | 2.024 |
| logSw: | -2.6413 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 90.655 |
| InChI Key: | ZBLXHMHCMFPSEV-UHFFFAOYSA-N |