2-{4-[4-(2-ethoxyphenyl)piperazin-1-yl]-3-nitrophenyl}-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione

Chemical Structure Depiction of
2-{4-[4-(2-ethoxyphenyl)piperazin-1-yl]-3-nitrophenyl}-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
Available: 89 mg
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mg
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Compound characteristics

Compound ID: K807-0413
Compound Name: 2-{4-[4-(2-ethoxyphenyl)piperazin-1-yl]-3-nitrophenyl}-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
Molecular Weight: 476.53
Molecular Formula: C26 H28 N4 O5
Smiles: CCOc1ccccc1N1CCN(CC1)c1ccc(cc1[N+]([O-])=O)N1C(C2CC=CCC2C1=O)=O
Stereo: MIXTURE OF STEREOISOMERS
logP: 4.0033
logD: 4.0032
logSw: -4.1478
Hydrogen bond acceptors count: 9
Polar surface area: 75.474
InChI Key: GTAYUKAULCJLQN-UHFFFAOYSA-N
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