3-[5-chloro-4-(4-fluoro-2-methylanilino)-6-oxopyridazin-1(6H)-yl]adamantane-1-carboxylic acid

Chemical Structure Depiction of
3-[5-chloro-4-(4-fluoro-2-methylanilino)-6-oxopyridazin-1(6H)-yl]adamantane-1-carboxylic acid
Available: 184 mg
Amount:
mg
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Compound characteristics

Compound ID: C301-2167
Compound Name: 3-[5-chloro-4-(4-fluoro-2-methylanilino)-6-oxopyridazin-1(6H)-yl]adamantane-1-carboxylic acid
Molecular Weight: 431.89
Molecular Formula: C22 H23 Cl F N3 O3
Smiles: Cc1cc(ccc1NC1C=NN(C(C=1[Cl])=O)C12CC3CC(CC(C3)(C2)C(O)=O)C1)F
Stereo: ACHIRAL
logP: 4.3424
logD: 2.0568
logSw: -4.3344
Hydrogen bond acceptors count: 6
Hydrogen bond donors count: 2
Polar surface area: 63.206
InChI Key: QPGSICPJLUSHPR-UHFFFAOYSA-N
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