3-(3-acetylanilino)-2-[(2H-1,3-benzodioxol-5-yl)methyl]-2,3-dihydro-1H-isoindol-1-one
Chemical Structure Depiction of
3-(3-acetylanilino)-2-[(2H-1,3-benzodioxol-5-yl)methyl]-2,3-dihydro-1H-isoindol-1-one
3-(3-acetylanilino)-2-[(2H-1,3-benzodioxol-5-yl)methyl]-2,3-dihydro-1H-isoindol-1-one
Compound characteristics
Compound ID: | C430-0141 |
Compound Name: | 3-(3-acetylanilino)-2-[(2H-1,3-benzodioxol-5-yl)methyl]-2,3-dihydro-1H-isoindol-1-one |
Molecular Weight: | 400.43 |
Molecular Formula: | C24 H20 N2 O4 |
Smiles: | CC(c1cccc(c1)NC1c2ccccc2C(N1Cc1ccc2c(c1)OCO2)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.7225 |
logD: | 3.7225 |
logSw: | -3.9933 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 55.944 |
InChI Key: | HRCUOZFWDGXWDA-HSZRJFAPSA-N |