methyl 4-[3-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)-3-(thiophen-2-yl)propanamido]benzoate
Chemical Structure Depiction of
methyl 4-[3-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)-3-(thiophen-2-yl)propanamido]benzoate
methyl 4-[3-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)-3-(thiophen-2-yl)propanamido]benzoate
Compound characteristics
| Compound ID: | E787-0397 |
| Compound Name: | methyl 4-[3-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)-3-(thiophen-2-yl)propanamido]benzoate |
| Molecular Weight: | 420.49 |
| Molecular Formula: | C23 H20 N2 O4 S |
| Smiles: | COC(c1ccc(cc1)NC(CC(c1cccs1)N1Cc2ccccc2C1=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8431 |
| logD: | 3.8426 |
| logSw: | -3.9898 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.046 |
| InChI Key: | NEXGVEIITOXZCZ-IBGZPJMESA-N |