2-{4-[2-(hexylamino)-4,4-dimethyl-6-oxocyclohex-1-en-1-yl]-4-oxobutyl}-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-{4-[2-(hexylamino)-4,4-dimethyl-6-oxocyclohex-1-en-1-yl]-4-oxobutyl}-1H-isoindole-1,3(2H)-dione
2-{4-[2-(hexylamino)-4,4-dimethyl-6-oxocyclohex-1-en-1-yl]-4-oxobutyl}-1H-isoindole-1,3(2H)-dione
Compound characteristics
Compound ID: | 8015-6443 |
Compound Name: | 2-{4-[2-(hexylamino)-4,4-dimethyl-6-oxocyclohex-1-en-1-yl]-4-oxobutyl}-1H-isoindole-1,3(2H)-dione |
Molecular Weight: | 438.57 |
Molecular Formula: | C26 H34 N2 O4 |
Smiles: | CCCCCCNC1CC(C)(C)CC(C=1C(CCCN1C(c2ccccc2C1=O)=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 4.1684 |
logD: | 4.1431 |
logSw: | -4.1932 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 66.313 |
InChI Key: | JZQCFLSACZXGHW-UHFFFAOYSA-N |