N-(6-acetyl-2H-1,3-benzodioxol-5-yl)-3-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)-3-(thiophen-2-yl)propanamide
Chemical Structure Depiction of
N-(6-acetyl-2H-1,3-benzodioxol-5-yl)-3-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)-3-(thiophen-2-yl)propanamide
N-(6-acetyl-2H-1,3-benzodioxol-5-yl)-3-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)-3-(thiophen-2-yl)propanamide
Compound characteristics
| Compound ID: | E787-0380 |
| Compound Name: | N-(6-acetyl-2H-1,3-benzodioxol-5-yl)-3-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)-3-(thiophen-2-yl)propanamide |
| Molecular Weight: | 448.5 |
| Molecular Formula: | C24 H20 N2 O5 S |
| Smiles: | CC(c1cc2c(cc1NC(CC(c1cccs1)N1Cc3ccccc3C1=O)=O)OCO2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1782 |
| logD: | 2.9309 |
| logSw: | -3.4782 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.116 |
| InChI Key: | NJCBZLJUONVBAG-IBGZPJMESA-N |