3-{[N-(butan-2-yl)(3,5-dimethoxyphenyl)carbamamido]methyl}phenyl ethanesulfonate

Chemical Structure Depiction of
3-{[N-(butan-2-yl)(3,5-dimethoxyphenyl)carbamamido]methyl}phenyl ethanesulfonate
Available: 1 mg
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mg
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Compound characteristics

Compound ID: V011-5981
Compound Name: 3-{[N-(butan-2-yl)(3,5-dimethoxyphenyl)carbamamido]methyl}phenyl ethanesulfonate
Molecular Weight: 450.55
Molecular Formula: C22 H30 N2 O6 S
Smiles: CCC(C)N(Cc1cccc(c1)OS(CC)(=O)=O)C(Nc1cc(cc(c1)OC)OC)=O
Stereo: RACEMIC MIXTURE
logP: 4.0751
logD: 4.0751
logSw: -4.1697
Hydrogen bond acceptors count: 9
Hydrogen bond donors count: 1
Polar surface area: 74.795
InChI Key: DYRIENPHPQMYFB-INIZCTEOSA-N
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