4-(3-bromophenyl)-1-chloro-2-[(2-nitrophenyl)sulfanyl]-2,3,3a,4,5,9b-hexahydro-1H-cyclopenta[c]quinoline-6-carboxylic acid

Chemical Structure Depiction of
4-(3-bromophenyl)-1-chloro-2-[(2-nitrophenyl)sulfanyl]-2,3,3a,4,5,9b-hexahydro-1H-cyclopenta[c]quinoline-6-carboxylic acid
Available: 28 mg
Amount:
mg
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Compound characteristics

Compound ID: 8009-7340
Compound Name: 4-(3-bromophenyl)-1-chloro-2-[(2-nitrophenyl)sulfanyl]-2,3,3a,4,5,9b-hexahydro-1H-cyclopenta[c]quinoline-6-carboxylic acid
Molecular Weight: 559.87
Molecular Formula: C25 H20 Br Cl N2 O4 S
Smiles: C1C2C(C(C1Sc1ccccc1[N+]([O-])=O)[Cl])c1cccc(C(O)=O)c1NC2c1cccc(c1)[Br]
Stereo: MIXTURE OF STEREOISOMERS
logP: 6.7752
logD: 4.3075
logSw: -5.8554
Hydrogen bond acceptors count: 8
Hydrogen bond donors count: 2
Polar surface area: 71.287
InChI Key: XAXWAUYMIPGHTD-UHFFFAOYSA-N
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