N-[2-(3,4-dimethoxyphenyl)ethyl]-6-[2-{[(2,5-dimethylphenyl)methyl]sulfanyl}-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]hexanamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-6-[2-{[(2,5-dimethylphenyl)methyl]sulfanyl}-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]hexanamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-6-[2-{[(2,5-dimethylphenyl)methyl]sulfanyl}-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]hexanamide
Compound characteristics
| Compound ID: | K292-1365 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-6-[2-{[(2,5-dimethylphenyl)methyl]sulfanyl}-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl]hexanamide |
| Molecular Weight: | 579.78 |
| Molecular Formula: | C31 H37 N3 O4 S2 |
| Smiles: | Cc1ccc(C)c(CSC2=Nc3ccsc3C(N2CCCCCC(NCCc2ccc(c(c2)OC)OC)=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 5.4076 |
| logD: | 5.4076 |
| logSw: | -5.0699 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.342 |
| InChI Key: | IKJIRJJVBVPOJK-UHFFFAOYSA-N |