2-(5-chloro-2-methylphenyl)-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-(5-chloro-2-methylphenyl)-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
2-(5-chloro-2-methylphenyl)-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | K603-0297 |
| Compound Name: | 2-(5-chloro-2-methylphenyl)-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione |
| Molecular Weight: | 275.73 |
| Molecular Formula: | C15 H14 Cl N O2 |
| Smiles: | Cc1ccc(cc1N1C(C2CC=CCC2C1=O)=O)[Cl] |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.2145 |
| logD: | 3.2145 |
| logSw: | -3.3675 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 28.771 |
| InChI Key: | BNJYHCZAVULWCS-UHFFFAOYSA-N |