2-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(3,4,5-trimethoxyanilino)-2,3-dihydro-1H-isoindol-1-one
Chemical Structure Depiction of
2-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(3,4,5-trimethoxyanilino)-2,3-dihydro-1H-isoindol-1-one
2-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(3,4,5-trimethoxyanilino)-2,3-dihydro-1H-isoindol-1-one
Compound characteristics
| Compound ID: | C430-0112 |
| Compound Name: | 2-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(3,4,5-trimethoxyanilino)-2,3-dihydro-1H-isoindol-1-one |
| Molecular Weight: | 448.47 |
| Molecular Formula: | C25 H24 N2 O6 |
| Smiles: | COc1cc(cc(c1OC)OC)NC1c2ccccc2C(N1Cc1ccc2c(c1)OCO2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3481 |
| logD: | 3.3481 |
| logSw: | -3.7505 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.095 |
| InChI Key: | UTSLQCHHGMJMDJ-XMMPIXPASA-N |