3-{4-[4-methyl-6-(pyrrolidin-1-yl)pyrimidin-2-yl]piperazine-1-carbonyl}-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-{4-[4-methyl-6-(pyrrolidin-1-yl)pyrimidin-2-yl]piperazine-1-carbonyl}-2H-1-benzopyran-2-one
3-{4-[4-methyl-6-(pyrrolidin-1-yl)pyrimidin-2-yl]piperazine-1-carbonyl}-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | G868-0547 |
| Compound Name: | 3-{4-[4-methyl-6-(pyrrolidin-1-yl)pyrimidin-2-yl]piperazine-1-carbonyl}-2H-1-benzopyran-2-one |
| Molecular Weight: | 419.48 |
| Molecular Formula: | C23 H25 N5 O3 |
| Smiles: | Cc1cc(nc(n1)N1CCN(CC1)C(C1=Cc2ccccc2OC1=O)=O)N1CCCC1 |
| Stereo: | ACHIRAL |
| logP: | 3.4233 |
| logD: | 3.3948 |
| logSw: | -3.655 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 61.655 |
| InChI Key: | BVSYXNMVERWFOK-UHFFFAOYSA-N |