2-{4-[2-(2-hydroxyanilino)-4,4-dimethyl-6-oxocyclohex-1-en-1-yl]-4-oxobutyl}-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-{4-[2-(2-hydroxyanilino)-4,4-dimethyl-6-oxocyclohex-1-en-1-yl]-4-oxobutyl}-1H-isoindole-1,3(2H)-dione
2-{4-[2-(2-hydroxyanilino)-4,4-dimethyl-6-oxocyclohex-1-en-1-yl]-4-oxobutyl}-1H-isoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | 8015-6448 |
| Compound Name: | 2-{4-[2-(2-hydroxyanilino)-4,4-dimethyl-6-oxocyclohex-1-en-1-yl]-4-oxobutyl}-1H-isoindole-1,3(2H)-dione |
| Molecular Weight: | 446.5 |
| Molecular Formula: | C26 H26 N2 O5 |
| Smiles: | CC1(C)CC(=C(C(CCCN2C(c3ccccc3C2=O)=O)=O)C(C1)=O)Nc1ccccc1O |
| Stereo: | ACHIRAL |
| logP: | 3.4914 |
| logD: | 1.4651 |
| logSw: | -3.3666 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.728 |
| InChI Key: | RKXQDQAEMQODGU-UHFFFAOYSA-N |