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

Chemical Structure Depiction of
2-(4-{[2-(4-chlorophenyl)ethyl]amino}-3-nitrophenyl)-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
Available: 61 mg
Amount:
mg
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Compound characteristics

Compound ID: K807-0458
Compound Name: 2-(4-{[2-(4-chlorophenyl)ethyl]amino}-3-nitrophenyl)-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
Molecular Weight: 425.87
Molecular Formula: C22 H20 Cl N3 O4
Smiles: C1C=CCC2C1C(N(C2=O)c1ccc(c(c1)[N+]([O-])=O)NCCc1ccc(cc1)[Cl])=O
Stereo: MIXTURE OF STEREOISOMERS
logP: 4.1318
logD: 4.1318
logSw: -4.7012
Hydrogen bond acceptors count: 8
Hydrogen bond donors count: 1
Polar surface area: 71.531
InChI Key: ZLAMWOTWAMBKOV-UHFFFAOYSA-N
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