methyl 2-{[3-(thiomorpholine-4-carbonyl)quinolin-4-yl]amino}benzoate

Chemical Structure Depiction of
methyl 2-{[3-(thiomorpholine-4-carbonyl)quinolin-4-yl]amino}benzoate
Available: 129 mg
Amount:
mg
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Compound characteristics

Compound ID: F080-1063
Compound Name: methyl 2-{[3-(thiomorpholine-4-carbonyl)quinolin-4-yl]amino}benzoate
Molecular Weight: 407.49
Molecular Formula: C22 H21 N3 O3 S
Smiles: COC(c1ccccc1Nc1c(cnc2ccccc12)C(N1CCSCC1)=O)=O
Stereo: ACHIRAL
logP: 3.4211
logD: 3.4163
logSw: -3.6118
Hydrogen bond acceptors count: 7
Hydrogen bond donors count: 1
Polar surface area: 53.732
InChI Key: DBQUSDCPKPCEDK-UHFFFAOYSA-N
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