3-[5-chloro-4-(3,4-dimethylanilino)-6-oxopyridazin-1(6H)-yl]adamantane-1-carboxylic acid

Chemical Structure Depiction of
3-[5-chloro-4-(3,4-dimethylanilino)-6-oxopyridazin-1(6H)-yl]adamantane-1-carboxylic acid
Available: 121 mg
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mg
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Compound characteristics

Compound ID: C301-2222
Compound Name: 3-[5-chloro-4-(3,4-dimethylanilino)-6-oxopyridazin-1(6H)-yl]adamantane-1-carboxylic acid
Molecular Weight: 427.93
Molecular Formula: C23 H26 Cl N3 O3
Smiles: Cc1ccc(cc1C)NC1C=NN(C(C=1[Cl])=O)C12CC3CC(CC(C3)(C2)C(O)=O)C1
Stereo: ACHIRAL
logP: 5.0515
logD: 2.7658
logSw: -4.8391
Hydrogen bond acceptors count: 6
Hydrogen bond donors count: 2
Polar surface area: 63.904
InChI Key: OOXRESWNZGILQC-UHFFFAOYSA-N
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