3-{4-[4-(2-methylphenyl)piperazine-1-carbonyl]anilino}-2-[(oxolan-2-yl)methyl]-2,3-dihydro-1H-isoindol-1-one
Chemical Structure Depiction of
3-{4-[4-(2-methylphenyl)piperazine-1-carbonyl]anilino}-2-[(oxolan-2-yl)methyl]-2,3-dihydro-1H-isoindol-1-one
3-{4-[4-(2-methylphenyl)piperazine-1-carbonyl]anilino}-2-[(oxolan-2-yl)methyl]-2,3-dihydro-1H-isoindol-1-one
Compound characteristics
| Compound ID: | V015-3405 |
| Compound Name: | 3-{4-[4-(2-methylphenyl)piperazine-1-carbonyl]anilino}-2-[(oxolan-2-yl)methyl]-2,3-dihydro-1H-isoindol-1-one |
| Molecular Weight: | 510.64 |
| Molecular Formula: | C31 H34 N4 O3 |
| Salt: | not_available |
| Smiles: | Cc1ccccc1N1CCN(CC1)C(c1ccc(cc1)NC1c2ccccc2C(N1CC1CCCO1)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.1574 |
| logD: | 4.1574 |
| logSw: | -4.2042 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.264 |
| InChI Key: | YLLDTDOUUPJACX-UHFFFAOYSA-N |