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2-{4-[4,4-dimethyl-2-(4-methylanilino)-6-oxocyclohex-1-en-1-yl]-4-oxobutyl}-1H-isoindole-1,3(2H)-dione

Chemical Structure Depiction of
2-{4-[4,4-dimethyl-2-(4-methylanilino)-6-oxocyclohex-1-en-1-yl]-4-oxobutyl}-1H-isoindole-1,3(2H)-dione
Available: 15 mg
Amount:
mg
Format:
$83.09
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Compound characteristics

Compound ID: 8015-6450
Compound Name: 2-{4-[4,4-dimethyl-2-(4-methylanilino)-6-oxocyclohex-1-en-1-yl]-4-oxobutyl}-1H-isoindole-1,3(2H)-dione
Molecular Weight: 444.53
Molecular Formula: C27 H28 N2 O4
Smiles: Cc1ccc(cc1)NC1CC(C)(C)CC(C=1C(CCCN1C(c2ccccc2C1=O)=O)=O)=O
Stereo: ACHIRAL
logP: 4.1229
logD: 2.8625
logSw: -4.2379
Hydrogen bond acceptors count: 8
Hydrogen bond donors count: 1
Polar surface area: 64.878
InChI Key: NEZCQQBOIRMEMC-UHFFFAOYSA-N
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