2-(4-ethoxyphenyl)-3-[3-(methylsulfanyl)anilino]-2,3-dihydro-1H-isoindol-1-one
Chemical Structure Depiction of
2-(4-ethoxyphenyl)-3-[3-(methylsulfanyl)anilino]-2,3-dihydro-1H-isoindol-1-one
2-(4-ethoxyphenyl)-3-[3-(methylsulfanyl)anilino]-2,3-dihydro-1H-isoindol-1-one
Compound characteristics
Compound ID: | C430-5033 |
Compound Name: | 2-(4-ethoxyphenyl)-3-[3-(methylsulfanyl)anilino]-2,3-dihydro-1H-isoindol-1-one |
Molecular Weight: | 390.5 |
Molecular Formula: | C23 H22 N2 O2 S |
Smiles: | CCOc1ccc(cc1)N1C(c2ccccc2C1=O)Nc1cccc(c1)SC |
Stereo: | RACEMIC MIXTURE |
logP: | 4.898 |
logD: | 4.898 |
logSw: | -4.5766 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 31.514 |
InChI Key: | FWERZXLNUAMYTM-QFIPXVFZSA-N |