5,6-bis(4-methoxyphenyl)-2-(naphthalen-1-yl)-4,7-diphenyl-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3,8(2H)-trione
Chemical Structure Depiction of
5,6-bis(4-methoxyphenyl)-2-(naphthalen-1-yl)-4,7-diphenyl-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3,8(2H)-trione
5,6-bis(4-methoxyphenyl)-2-(naphthalen-1-yl)-4,7-diphenyl-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3,8(2H)-trione
Compound characteristics
| Compound ID: | 1935-0186 |
| Compound Name: | 5,6-bis(4-methoxyphenyl)-2-(naphthalen-1-yl)-4,7-diphenyl-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3,8(2H)-trione |
| Molecular Weight: | 667.76 |
| Molecular Formula: | C45 H33 N O5 |
| Smiles: | COc1ccc(cc1)C1=C(c2ccc(cc2)OC)C2(C3C(C(N(C3=O)c3cccc4ccccc34)=O)C1(C2=O)c1ccccc1)c1ccccc1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 8.181 |
| logD: | 8.1786 |
| logSw: | -6.9791 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 56.3 |
| InChI Key: | AHRRZEXYDPZLAJ-UHFFFAOYSA-N |