N-{2-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]-1-benzofuran-3-yl}-3-(thiophen-2-yl)prop-2-enamide
Chemical Structure Depiction of
N-{2-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]-1-benzofuran-3-yl}-3-(thiophen-2-yl)prop-2-enamide
N-{2-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]-1-benzofuran-3-yl}-3-(thiophen-2-yl)prop-2-enamide
Compound characteristics
| Compound ID: | E957-1837 |
| Compound Name: | N-{2-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]-1-benzofuran-3-yl}-3-(thiophen-2-yl)prop-2-enamide |
| Molecular Weight: | 459.53 |
| Molecular Formula: | C24 H21 N5 O3 S |
| Smiles: | C1CN(CCN1C(c1c(c2ccccc2o1)NC(/C=C/c1cccs1)=O)=O)c1ncccn1 |
| Stereo: | ACHIRAL |
| logP: | 3.7616 |
| logD: | 3.7251 |
| logSw: | -4.0754 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.536 |
| InChI Key: | AJOXGURKVSIDNL-UHFFFAOYSA-N |