N-{3-[benzyl(ethyl)amino]propyl}-4-[2-(5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl)acetamido]butanamide
Chemical Structure Depiction of
N-{3-[benzyl(ethyl)amino]propyl}-4-[2-(5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl)acetamido]butanamide
N-{3-[benzyl(ethyl)amino]propyl}-4-[2-(5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl)acetamido]butanamide
Compound characteristics
| Compound ID: | C060-0118 |
| Compound Name: | N-{3-[benzyl(ethyl)amino]propyl}-4-[2-(5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl)acetamido]butanamide |
| Molecular Weight: | 497.66 |
| Molecular Formula: | C26 H35 N5 O3 S |
| Smiles: | CCN(CCCNC(CCCNC(CN1C=Nc2c(C1=O)c(C)c(C)s2)=O)=O)Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 1.4037 |
| logD: | -0.2433 |
| logSw: | -2.2767 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.554 |
| InChI Key: | OGKPFHSWBHIAOL-UHFFFAOYSA-N |