2-[6-(4-benzylpiperazine-1-carbonyl)-5-methyl-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl]-N-(3-chloro-4-methylphenyl)acetamide
Chemical Structure Depiction of
2-[6-(4-benzylpiperazine-1-carbonyl)-5-methyl-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl]-N-(3-chloro-4-methylphenyl)acetamide
2-[6-(4-benzylpiperazine-1-carbonyl)-5-methyl-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl]-N-(3-chloro-4-methylphenyl)acetamide
Compound characteristics
| Compound ID: | K892-0325 |
| Compound Name: | 2-[6-(4-benzylpiperazine-1-carbonyl)-5-methyl-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl]-N-(3-chloro-4-methylphenyl)acetamide |
| Molecular Weight: | 550.08 |
| Molecular Formula: | C28 H28 Cl N5 O3 S |
| Smiles: | Cc1ccc(cc1[Cl])NC(CN1C=Nc2c(C1=O)c(C)c(C(N1CCN(CC1)Cc1ccccc1)=O)s2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2932 |
| logD: | 4.2783 |
| logSw: | -4.6753 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.579 |
| InChI Key: | GGMATYYFJYZKDI-UHFFFAOYSA-N |