2-(4-methoxy-2-nitrophenyl)-4,7-dimethyl-5,6-diphenyl-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3,8(2H)-trione
Chemical Structure Depiction of
2-(4-methoxy-2-nitrophenyl)-4,7-dimethyl-5,6-diphenyl-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3,8(2H)-trione
2-(4-methoxy-2-nitrophenyl)-4,7-dimethyl-5,6-diphenyl-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3,8(2H)-trione
Compound characteristics
| Compound ID: | 2140-0151 |
| Compound Name: | 2-(4-methoxy-2-nitrophenyl)-4,7-dimethyl-5,6-diphenyl-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3,8(2H)-trione |
| Molecular Weight: | 508.53 |
| Molecular Formula: | C30 H24 N2 O6 |
| Smiles: | CC12C3C(C(N(C3=O)c3ccc(cc3[N+]([O-])=O)OC)=O)C(C)(C(=C1c1ccccc1)c1ccccc1)C2=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.3034 |
| logD: | 4.3034 |
| logSw: | -4.5459 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 82.651 |
| InChI Key: | QICJCQWEUWRYLQ-UHFFFAOYSA-N |