ethyl 4-{[N-(2-oxo-1,2,3,4-tetrahydroquinoline-6-sulfonyl)-beta-alanyl]amino}benzoate

Chemical Structure Depiction of
ethyl 4-{[N-(2-oxo-1,2,3,4-tetrahydroquinoline-6-sulfonyl)-beta-alanyl]amino}benzoate
Available: 5 mg
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mg
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Compound characteristics

Compound ID: C464-3088
Compound Name: ethyl 4-{[N-(2-oxo-1,2,3,4-tetrahydroquinoline-6-sulfonyl)-beta-alanyl]amino}benzoate
Molecular Weight: 445.49
Molecular Formula: C21 H23 N3 O6 S
Smiles: CCOC(c1ccc(cc1)NC(CCNS(c1ccc2c(CCC(N2)=O)c1)(=O)=O)=O)=O
Stereo: ACHIRAL
logP: 2.2742
logD: 2.2729
logSw: -2.9965
Hydrogen bond acceptors count: 12
Hydrogen bond donors count: 3
Polar surface area: 110.562
InChI Key: ZYHBAQJOWJDPFN-UHFFFAOYSA-N
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