6,8-dibromo-3-{4-[4-methyl-6-(piperidin-1-yl)pyrimidin-2-yl]piperazine-1-carbonyl}-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6,8-dibromo-3-{4-[4-methyl-6-(piperidin-1-yl)pyrimidin-2-yl]piperazine-1-carbonyl}-2H-1-benzopyran-2-one
6,8-dibromo-3-{4-[4-methyl-6-(piperidin-1-yl)pyrimidin-2-yl]piperazine-1-carbonyl}-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | G868-0650 |
| Compound Name: | 6,8-dibromo-3-{4-[4-methyl-6-(piperidin-1-yl)pyrimidin-2-yl]piperazine-1-carbonyl}-2H-1-benzopyran-2-one |
| Molecular Weight: | 591.3 |
| Molecular Formula: | C24 H25 Br2 N5 O3 |
| Smiles: | Cc1cc(nc(n1)N1CCN(CC1)C(C1=Cc2cc(cc(c2OC1=O)[Br])[Br])=O)N1CCCCC1 |
| Stereo: | ACHIRAL |
| logP: | 5.59 |
| logD: | 5.5616 |
| logSw: | -5.2774 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 60.973 |
| InChI Key: | TUNVKQFKJCJIHE-UHFFFAOYSA-N |