3-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-4-(4-methylphenyl)-1H-2-benzopyran-1-one
Chemical Structure Depiction of
3-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-4-(4-methylphenyl)-1H-2-benzopyran-1-one
3-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-4-(4-methylphenyl)-1H-2-benzopyran-1-one
Compound characteristics
| Compound ID: | K953-0091 |
| Compound Name: | 3-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-4-(4-methylphenyl)-1H-2-benzopyran-1-one |
| Molecular Weight: | 454.53 |
| Molecular Formula: | C28 H26 N2 O4 |
| Smiles: | Cc1ccc(cc1)C1=C(C(N2CCN(CC2)c2ccccc2OC)=O)OC(c2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5959 |
| logD: | 4.5958 |
| logSw: | -4.5558 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 48.206 |
| InChI Key: | ZPAGBHGMKHQIFH-UHFFFAOYSA-N |