2-[(2-chlorophenyl)methyl]-3-[3-(methylsulfanyl)anilino]-2,3-dihydro-1H-isoindol-1-one
Chemical Structure Depiction of
2-[(2-chlorophenyl)methyl]-3-[3-(methylsulfanyl)anilino]-2,3-dihydro-1H-isoindol-1-one
2-[(2-chlorophenyl)methyl]-3-[3-(methylsulfanyl)anilino]-2,3-dihydro-1H-isoindol-1-one
Compound characteristics
| Compound ID: | C429-0485 |
| Compound Name: | 2-[(2-chlorophenyl)methyl]-3-[3-(methylsulfanyl)anilino]-2,3-dihydro-1H-isoindol-1-one |
| Molecular Weight: | 394.92 |
| Molecular Formula: | C22 H19 Cl N2 O S |
| Smiles: | CSc1cccc(c1)NC1c2ccccc2C(N1Cc1ccccc1[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.3898 |
| logD: | 5.3898 |
| logSw: | -5.8251 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 25.0019 |
| InChI Key: | LLBKWRYBICSQRV-NRFANRHFSA-N |