methyl 4-({[2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-4-(methanesulfonyl)butanoyl]oxy}methyl)benzoate
Chemical Structure Depiction of
methyl 4-({[2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-4-(methanesulfonyl)butanoyl]oxy}methyl)benzoate
methyl 4-({[2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-4-(methanesulfonyl)butanoyl]oxy}methyl)benzoate
Compound characteristics
| Compound ID: | 6420-0472 |
| Compound Name: | methyl 4-({[2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-4-(methanesulfonyl)butanoyl]oxy}methyl)benzoate |
| Molecular Weight: | 459.47 |
| Molecular Formula: | C22 H21 N O8 S |
| Smiles: | COC(c1ccc(COC(C(CCS(C)(=O)=O)N2C(c3ccccc3C2=O)=O)=O)cc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3887 |
| logD: | 2.3887 |
| logSw: | -2.7134 |
| Hydrogen bond acceptors count: | 14 |
| Polar surface area: | 99.733 |
| InChI Key: | LEXFUHGUZHSTBW-SFHVURJKSA-N |