2-(5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl)-N-{4-[4-(4-methoxyphenyl)piperazin-1-yl]-4-oxobutyl}acetamide
Chemical Structure Depiction of
2-(5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl)-N-{4-[4-(4-methoxyphenyl)piperazin-1-yl]-4-oxobutyl}acetamide
2-(5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl)-N-{4-[4-(4-methoxyphenyl)piperazin-1-yl]-4-oxobutyl}acetamide
Compound characteristics
| Compound ID: | C060-0104 |
| Compound Name: | 2-(5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl)-N-{4-[4-(4-methoxyphenyl)piperazin-1-yl]-4-oxobutyl}acetamide |
| Molecular Weight: | 497.62 |
| Molecular Formula: | C25 H31 N5 O4 S |
| Smiles: | Cc1c2C(N(CC(NCCCC(N3CCN(CC3)c3ccc(cc3)OC)=O)=O)C=Nc2sc1C)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6592 |
| logD: | 1.6588 |
| logSw: | -2.4296 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.751 |
| InChI Key: | LJHUVJCBWSWTMP-UHFFFAOYSA-N |