2-benzyl-3-(pentafluoroanilino)-2,3-dihydro-1H-isoindol-1-one
Chemical Structure Depiction of
2-benzyl-3-(pentafluoroanilino)-2,3-dihydro-1H-isoindol-1-one
2-benzyl-3-(pentafluoroanilino)-2,3-dihydro-1H-isoindol-1-one
Compound characteristics
| Compound ID: | C612-0488 |
| Compound Name: | 2-benzyl-3-(pentafluoroanilino)-2,3-dihydro-1H-isoindol-1-one |
| Molecular Weight: | 404.34 |
| Molecular Formula: | C21 H13 F5 N2 O |
| Smiles: | C(c1ccccc1)N1C(c2ccccc2C1=O)Nc1c(c(c(c(c1F)F)F)F)F |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.656 |
| logD: | 4.6283 |
| logSw: | -4.7661 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 23.6063 |
| InChI Key: | QVWNSBKZEXABAT-FQEVSTJZSA-N |