3-[4-(4-benzylpiperazine-1-carbonyl)anilino]-2-[(4-fluorophenyl)methyl]-2,3-dihydro-1H-isoindol-1-one
Chemical Structure Depiction of
3-[4-(4-benzylpiperazine-1-carbonyl)anilino]-2-[(4-fluorophenyl)methyl]-2,3-dihydro-1H-isoindol-1-one
3-[4-(4-benzylpiperazine-1-carbonyl)anilino]-2-[(4-fluorophenyl)methyl]-2,3-dihydro-1H-isoindol-1-one
Compound characteristics
| Compound ID: | V002-9772 |
| Compound Name: | 3-[4-(4-benzylpiperazine-1-carbonyl)anilino]-2-[(4-fluorophenyl)methyl]-2,3-dihydro-1H-isoindol-1-one |
| Molecular Weight: | 534.63 |
| Molecular Formula: | C33 H31 F N4 O2 |
| Salt: | not_available |
| Smiles: | C1CN(CCN1Cc1ccccc1)C(c1ccc(cc1)NC1c2ccccc2C(N1Cc1ccc(cc1)F)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4886 |
| logD: | 4.4731 |
| logSw: | -4.4308 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.191 |
| InChI Key: | IIPWSOPXQOFRNC-HKBQPEDESA-N |