ethyl 3-({2-[(2H-1,3-benzodioxol-5-yl)methyl]-3-oxo-2,3-dihydro-1H-isoindol-1-yl}amino)benzoate
Chemical Structure Depiction of
ethyl 3-({2-[(2H-1,3-benzodioxol-5-yl)methyl]-3-oxo-2,3-dihydro-1H-isoindol-1-yl}amino)benzoate
ethyl 3-({2-[(2H-1,3-benzodioxol-5-yl)methyl]-3-oxo-2,3-dihydro-1H-isoindol-1-yl}amino)benzoate
Compound characteristics
| Compound ID: | C430-0191 |
| Compound Name: | ethyl 3-({2-[(2H-1,3-benzodioxol-5-yl)methyl]-3-oxo-2,3-dihydro-1H-isoindol-1-yl}amino)benzoate |
| Molecular Weight: | 430.46 |
| Molecular Formula: | C25 H22 N2 O5 |
| Smiles: | CCOC(c1cccc(c1)NC1c2ccccc2C(N1Cc1ccc2c(c1)OCO2)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7636 |
| logD: | 4.7636 |
| logSw: | -4.5103 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.871 |
| InChI Key: | UGGCPUDCVLOGAJ-HSZRJFAPSA-N |