3-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]-2H-1-benzopyran-2-one
3-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y200-0413 |
| Compound Name: | 3-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]-2H-1-benzopyran-2-one |
| Molecular Weight: | 336.35 |
| Molecular Formula: | C18 H16 N4 O3 |
| Smiles: | C1CN(CCN1C(C1=Cc2ccccc2OC1=O)=O)c1ncccn1 |
| Stereo: | ACHIRAL |
| logP: | 1.8879 |
| logD: | 1.8879 |
| logSw: | -2.2237 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 59.431 |
| InChI Key: | RYEWVKHAGWKDKF-UHFFFAOYSA-N |