1-{4-[3,5-bis(methoxycarbonyl)anilino]-5-chloro-6-oxopyridazin-1(6H)-yl}adamantane-2-carboxylic acid

Chemical Structure Depiction of
1-{4-[3,5-bis(methoxycarbonyl)anilino]-5-chloro-6-oxopyridazin-1(6H)-yl}adamantane-2-carboxylic acid
Available: 92 mg
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mg
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Compound characteristics

Compound ID: C850-0005
Compound Name: 1-{4-[3,5-bis(methoxycarbonyl)anilino]-5-chloro-6-oxopyridazin-1(6H)-yl}adamantane-2-carboxylic acid
Molecular Weight: 515.95
Molecular Formula: C25 H26 Cl N3 O7
Smiles: COC(c1cc(cc(c1)NC1C=NN(C(C=1[Cl])=O)C12CC3CC(CC(C3)C2C(O)=O)C1)C(=O)OC)=O
Stereo: RACEMIC MIXTURE
logP: 3.9832
logD: 1.6471
logSw: -4.2471
Hydrogen bond acceptors count: 12
Hydrogen bond donors count: 2
Polar surface area: 105.717
InChI Key: SFRSWRCYXKYOCG-UHFFFAOYSA-N
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