3a-anilino-8-(7-methoxy-2H-1,3-benzodioxol-5-yl)-4-phenyl-3a,5,8,8a-tetrahydro-1H,3H-difuro[3,4-b:3',4'-e]pyridine-1,7(4H)-dione
Chemical Structure Depiction of
3a-anilino-8-(7-methoxy-2H-1,3-benzodioxol-5-yl)-4-phenyl-3a,5,8,8a-tetrahydro-1H,3H-difuro[3,4-b:3',4'-e]pyridine-1,7(4H)-dione
3a-anilino-8-(7-methoxy-2H-1,3-benzodioxol-5-yl)-4-phenyl-3a,5,8,8a-tetrahydro-1H,3H-difuro[3,4-b:3',4'-e]pyridine-1,7(4H)-dione
Compound characteristics
| Compound ID: | 8020-1446 |
| Compound Name: | 3a-anilino-8-(7-methoxy-2H-1,3-benzodioxol-5-yl)-4-phenyl-3a,5,8,8a-tetrahydro-1H,3H-difuro[3,4-b:3',4'-e]pyridine-1,7(4H)-dione |
| Molecular Weight: | 512.52 |
| Molecular Formula: | C29 H24 N2 O7 |
| Smiles: | COc1cc(cc2c1OCO2)C1C2C(=O)OCC2(Nc2ccccc2)N(C2COC(C1=2)=O)c1ccccc1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.942 |
| logD: | 3.942 |
| logSw: | -4.0697 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.369 |
| InChI Key: | XYGODGIBYGKECA-UHFFFAOYSA-N |