tert-butyl {[5-(2-methylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetate

Chemical Structure Depiction of
tert-butyl {[5-(2-methylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
Available: 35 mg
Amount:
mg
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Compound characteristics

Compound ID: V002-8595
Compound Name: tert-butyl {[5-(2-methylphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetate
Molecular Weight: 381.5
Molecular Formula: C21 H23 N3 O2 S
Salt: not_available
Smiles: Cc1ccccc1c1nnc(n1c1ccccc1)SCC(=O)OC(C)(C)C
Stereo: ACHIRAL
logP: 4.8851
logD: 4.885
logSw: -4.6592
Hydrogen bond acceptors count: 6
Polar surface area: 44.252
InChI Key: AWTDVCGUGBGDMJ-UHFFFAOYSA-N
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