methyl 5-({[5-benzyl-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)furan-2-carboxylate

Chemical Structure Depiction of
methyl 5-({[5-benzyl-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)furan-2-carboxylate
Available: 6 mg
Amount:
mg
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Compound characteristics

Compound ID: V010-1449
Compound Name: methyl 5-({[5-benzyl-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)furan-2-carboxylate
Molecular Weight: 419.5
Molecular Formula: C23 H21 N3 O3 S
Salt: not_available
Smiles: Cc1cccc(c1)n1c(Cc2ccccc2)nnc1SCc1ccc(C(=O)OC)o1
Stereo: ACHIRAL
logP: 4.9475
logD: 4.9475
logSw: -4.8011
Hydrogen bond acceptors count: 7
Polar surface area: 54.704
InChI Key: HNAXZHVABOJBPG-UHFFFAOYSA-N
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