methyl 8-{4-[(5-{[4-(methylsulfanyl)phenyl]methoxy}-4-oxo-4H-pyran-2-yl)methyl]piperazin-1-yl}-8-oxooctanoate

Chemical Structure Depiction of
methyl 8-{4-[(5-{[4-(methylsulfanyl)phenyl]methoxy}-4-oxo-4H-pyran-2-yl)methyl]piperazin-1-yl}-8-oxooctanoate
Available: 2 mg
Amount:
mg
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Compound characteristics

Compound ID: V007-1641
Compound Name: methyl 8-{4-[(5-{[4-(methylsulfanyl)phenyl]methoxy}-4-oxo-4H-pyran-2-yl)methyl]piperazin-1-yl}-8-oxooctanoate
Molecular Weight: 516.66
Molecular Formula: C27 H36 N2 O6 S
Salt: not_available
Smiles: COC(CCCCCCC(N1CCN(CC1)CC1=CC(C(=CO1)OCc1ccc(cc1)SC)=O)=O)=O
Stereo: ACHIRAL
logP: 3.1031
logD: 3.1024
logSw: -3.2538
Hydrogen bond acceptors count: 11
Polar surface area: 70.662
InChI Key: NQWSIMWTNJYPHG-UHFFFAOYSA-N
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