3-{4-[2-methyl-6-(4-methylanilino)pyrimidin-4-yl]piperazine-1-carbonyl}-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-{4-[2-methyl-6-(4-methylanilino)pyrimidin-4-yl]piperazine-1-carbonyl}-2H-1-benzopyran-2-one
3-{4-[2-methyl-6-(4-methylanilino)pyrimidin-4-yl]piperazine-1-carbonyl}-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | D430-0263 |
| Compound Name: | 3-{4-[2-methyl-6-(4-methylanilino)pyrimidin-4-yl]piperazine-1-carbonyl}-2H-1-benzopyran-2-one |
| Molecular Weight: | 455.52 |
| Molecular Formula: | C26 H25 N5 O3 |
| Smiles: | Cc1ccc(cc1)Nc1cc(nc(C)n1)N1CCN(CC1)C(C1=Cc2ccccc2OC1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4137 |
| logD: | 3.8976 |
| logSw: | -4.3588 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.196 |
| InChI Key: | VUEWJJAYQMXZIG-UHFFFAOYSA-N |