2-[2-(cyclohex-1-en-1-yl)ethyl]-3a-methyl-4,7-diphenyl-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-[2-(cyclohex-1-en-1-yl)ethyl]-3a-methyl-4,7-diphenyl-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
2-[2-(cyclohex-1-en-1-yl)ethyl]-3a-methyl-4,7-diphenyl-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | 8004-9128 |
| Compound Name: | 2-[2-(cyclohex-1-en-1-yl)ethyl]-3a-methyl-4,7-diphenyl-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione |
| Molecular Weight: | 425.57 |
| Molecular Formula: | C29 H31 N O2 |
| Smiles: | CC12C(C=CC(C1C(N(CCC1CCCCC=1)C2=O)=O)c1ccccc1)c1ccccc1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.6416 |
| logD: | 5.6416 |
| logSw: | -5.431 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 29.3109 |
| InChI Key: | IRKARXPTWCTTMK-UHFFFAOYSA-N |