ethyl 2-[2-({4-benzyl-5-[(2-phenoxyacetamido)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)propanamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Chemical Structure Depiction of
ethyl 2-[2-({4-benzyl-5-[(2-phenoxyacetamido)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)propanamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Available: 319 mg
Amount:
mg
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Compound characteristics

Compound ID: K403-1023
Compound Name: ethyl 2-[2-({4-benzyl-5-[(2-phenoxyacetamido)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)propanamido]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Molecular Weight: 633.79
Molecular Formula: C32 H35 N5 O5 S2
Smiles: CCOC(c1c2CCCCc2sc1NC(C(C)Sc1nnc(CNC(COc2ccccc2)=O)n1Cc1ccccc1)=O)=O
Stereo: RACEMIC MIXTURE
logP: 5.3211
logD: 3.0194
logSw: -5.1767
Hydrogen bond acceptors count: 11
Hydrogen bond donors count: 2
Polar surface area: 100.747
InChI Key: GAZXQHFPSBGWOU-NRFANRHFSA-N
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