3-[5-chloro-4-{[(4-fluorophenyl)methyl]amino}-6-oxopyridazin-1(6H)-yl]adamantane-1-carboxylic acid

Chemical Structure Depiction of
3-[5-chloro-4-{[(4-fluorophenyl)methyl]amino}-6-oxopyridazin-1(6H)-yl]adamantane-1-carboxylic acid
Available: 100 mg
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mg
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Compound characteristics

Compound ID: C301-2242
Compound Name: 3-[5-chloro-4-{[(4-fluorophenyl)methyl]amino}-6-oxopyridazin-1(6H)-yl]adamantane-1-carboxylic acid
Molecular Weight: 431.89
Molecular Formula: C22 H23 Cl F N3 O3
Smiles: C1C2CC3(CC1CC(C2)(C3)N1C(C(=C(C=N1)NCc1ccc(cc1)F)[Cl])=O)C(O)=O
Stereo: ACHIRAL
logP: 3.6234
logD: 1.3378
logSw: -3.7425
Hydrogen bond acceptors count: 6
Hydrogen bond donors count: 2
Polar surface area: 65.226
InChI Key: DVLBBESTJWLSRY-UHFFFAOYSA-N
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