methyl 5'-[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanamido][2,3'-bithiophene]-4'-carboxylate
Chemical Structure Depiction of
methyl 5'-[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanamido][2,3'-bithiophene]-4'-carboxylate
methyl 5'-[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanamido][2,3'-bithiophene]-4'-carboxylate
Compound characteristics
| Compound ID: | D304-0115 |
| Compound Name: | methyl 5'-[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanamido][2,3'-bithiophene]-4'-carboxylate |
| Molecular Weight: | 454.52 |
| Molecular Formula: | C22 H18 N2 O5 S2 |
| Smiles: | COC(c1c(csc1NC(CCCN1C(c2ccccc2C1=O)=O)=O)c1cccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9608 |
| logD: | 2.9271 |
| logSw: | -3.5393 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.334 |
| InChI Key: | YBBUTZVZOQYNFZ-UHFFFAOYSA-N |