ethyl 10-ethoxy-2-methyl-3-(2-phenylethyl)-4-sulfanylidene-3,4,5,6-tetrahydro-2H-2,6-methano-1,3,5-benzoxadiazocine-11-carboxylate

Chemical Structure Depiction of
ethyl 10-ethoxy-2-methyl-3-(2-phenylethyl)-4-sulfanylidene-3,4,5,6-tetrahydro-2H-2,6-methano-1,3,5-benzoxadiazocine-11-carboxylate
Available: 96 mg
Amount:
mg
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Compound characteristics

Compound ID: K272-0714
Compound Name: ethyl 10-ethoxy-2-methyl-3-(2-phenylethyl)-4-sulfanylidene-3,4,5,6-tetrahydro-2H-2,6-methano-1,3,5-benzoxadiazocine-11-carboxylate
Molecular Weight: 440.56
Molecular Formula: C24 H28 N2 O4 S
Smiles: CCOC(C1C2c3cccc(c3OC1(C)N(CCc1ccccc1)C(N2)=S)OCC)=O
Stereo: MIXTURE OF STEREOISOMERS
logP: 4.9179
logD: 4.9179
logSw: -4.5883
Hydrogen bond acceptors count: 7
Hydrogen bond donors count: 1
Polar surface area: 48.75
InChI Key: BNUHYKUAOLHJTE-UHFFFAOYSA-N
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