2-{3-[4-(4-methoxyphenyl)piperazine-1-carbonyl]phenyl}-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-{3-[4-(4-methoxyphenyl)piperazine-1-carbonyl]phenyl}-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
2-{3-[4-(4-methoxyphenyl)piperazine-1-carbonyl]phenyl}-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | K655-0157 |
| Compound Name: | 2-{3-[4-(4-methoxyphenyl)piperazine-1-carbonyl]phenyl}-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione |
| Molecular Weight: | 445.52 |
| Molecular Formula: | C26 H27 N3 O4 |
| Smiles: | COc1ccc(cc1)N1CCN(CC1)C(c1cccc(c1)N1C(C2CC=CCC2C1=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.7359 |
| logD: | 2.7359 |
| logSw: | -3.1179 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 56.524 |
| InChI Key: | ILHZQKHDKUUGQA-UHFFFAOYSA-N |