2-(4-{[2-(3-methoxyphenyl)ethyl]amino}-3-nitrophenyl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione

Chemical Structure Depiction of
2-(4-{[2-(3-methoxyphenyl)ethyl]amino}-3-nitrophenyl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
Available: 141 mg
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mg
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Compound characteristics

Compound ID: K807-1074
Compound Name: 2-(4-{[2-(3-methoxyphenyl)ethyl]amino}-3-nitrophenyl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
Molecular Weight: 433.46
Molecular Formula: C24 H23 N3 O5
Smiles: COc1cccc(CCNc2ccc(cc2[N+]([O-])=O)N2C(C3C4CC(C=C4)C3C2=O)=O)c1
Stereo: MIXTURE OF STEREOISOMERS
logP: 3.0846
logD: 3.0846
logSw: -3.5958
Hydrogen bond acceptors count: 9
Hydrogen bond donors count: 1
Polar surface area: 79.727
InChI Key: ORKBNPLPCJMTAM-UHFFFAOYSA-N
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