2-(2,5-dimethylphenyl)-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-(2,5-dimethylphenyl)-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
2-(2,5-dimethylphenyl)-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | 4483-1159 |
| Compound Name: | 2-(2,5-dimethylphenyl)-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione |
| Molecular Weight: | 255.31 |
| Molecular Formula: | C16 H17 N O2 |
| Smiles: | Cc1ccc(C)c(c1)N1C(C2CC=CCC2C1=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.0898 |
| logD: | 3.0898 |
| logSw: | -3.1075 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 28.771 |
| InChI Key: | YAACBRBGDYDZGH-UHFFFAOYSA-N |