ethyl 2-({2-[4-(propan-2-yl)phenyl]quinoline-4-carbonyl}amino)-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophene-3-carboxylate

Chemical Structure Depiction of
ethyl 2-({2-[4-(propan-2-yl)phenyl]quinoline-4-carbonyl}amino)-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophene-3-carboxylate
Available: 28 mg
Amount:
mg
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Compound characteristics

Compound ID: Y503-0009
Compound Name: ethyl 2-({2-[4-(propan-2-yl)phenyl]quinoline-4-carbonyl}amino)-4,5,6,7,8,9,10,11,12,13-decahydrocyclododeca[b]thiophene-3-carboxylate
Molecular Weight: 582.81
Molecular Formula: C36 H42 N2 O3 S
Smiles: CCOC(c1c2CCCCCCCCCCc2sc1NC(c1cc(c2ccc(cc2)C(C)C)nc2ccccc12)=O)=O
Stereo: ACHIRAL
logP: 10.9878
logD: 9.0485
logSw: -5.9495
Hydrogen bond acceptors count: 6
Hydrogen bond donors count: 1
Polar surface area: 52.188
InChI Key: UFZGZVQNENLIAR-UHFFFAOYSA-N
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