2-[4-(2-anilino-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)-4-oxobutyl]-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-[4-(2-anilino-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)-4-oxobutyl]-1H-isoindole-1,3(2H)-dione
2-[4-(2-anilino-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)-4-oxobutyl]-1H-isoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | 8015-6446 |
| Compound Name: | 2-[4-(2-anilino-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)-4-oxobutyl]-1H-isoindole-1,3(2H)-dione |
| Molecular Weight: | 430.5 |
| Molecular Formula: | C26 H26 N2 O4 |
| Smiles: | CC1(C)CC(=C(C(CCCN2C(c3ccccc3C2=O)=O)=O)C(C1)=O)Nc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.5077 |
| logD: | 2.361 |
| logSw: | -3.7998 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.878 |
| InChI Key: | AHTVQRLIBIGEPB-UHFFFAOYSA-N |