4-[4-(acetyloxy)phenyl]-9-nitro-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-6-carboxylic acid

Chemical Structure Depiction of
4-[4-(acetyloxy)phenyl]-9-nitro-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-6-carboxylic acid
Available: 69 mg
Amount:
mg
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Compound characteristics

Compound ID: 4597-0013
Compound Name: 4-[4-(acetyloxy)phenyl]-9-nitro-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-6-carboxylic acid
Molecular Weight: 394.38
Molecular Formula: C21 H18 N2 O6
Smiles: CC(=O)Oc1ccc(cc1)C1C2CC=CC2c2c(ccc(C(O)=O)c2N1)[N+]([O-])=O
Stereo: MIXTURE OF STEREOISOMERS
logP: 3.5046
logD: 0.8706
logSw: -3.8404
Hydrogen bond acceptors count: 10
Hydrogen bond donors count: 2
Polar surface area: 92.309
InChI Key: LFUPVDOJTYKZBC-UHFFFAOYSA-N
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