N-{4-[4-(3-chlorophenyl)piperazin-1-yl]-4-oxobutyl}-2-(5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl)acetamide
Chemical Structure Depiction of
N-{4-[4-(3-chlorophenyl)piperazin-1-yl]-4-oxobutyl}-2-(5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl)acetamide
N-{4-[4-(3-chlorophenyl)piperazin-1-yl]-4-oxobutyl}-2-(5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl)acetamide
Compound characteristics
| Compound ID: | C060-0053 |
| Compound Name: | N-{4-[4-(3-chlorophenyl)piperazin-1-yl]-4-oxobutyl}-2-(5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3(4H)-yl)acetamide |
| Molecular Weight: | 502.03 |
| Molecular Formula: | C24 H28 Cl N5 O3 S |
| Smiles: | Cc1c2C(N(CC(NCCCC(N3CCN(CC3)c3cccc(c3)[Cl])=O)=O)C=Nc2sc1C)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1389 |
| logD: | 2.1388 |
| logSw: | -3.6162 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.207 |
| InChI Key: | KIPDCNRRMJCHMI-UHFFFAOYSA-N |