1-[5-(2H-1,3-benzodioxol-5-yl)-1-(4-chlorophenyl)-4-(4-ethoxyphenyl)-4,5-dihydro-1H-1,2,4-triazol-3-yl]ethan-1-one

Chemical Structure Depiction of
1-[5-(2H-1,3-benzodioxol-5-yl)-1-(4-chlorophenyl)-4-(4-ethoxyphenyl)-4,5-dihydro-1H-1,2,4-triazol-3-yl]ethan-1-one
Available: 96 mg
Amount:
mg
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Compound characteristics

Compound ID: 5868-0093
Compound Name: 1-[5-(2H-1,3-benzodioxol-5-yl)-1-(4-chlorophenyl)-4-(4-ethoxyphenyl)-4,5-dihydro-1H-1,2,4-triazol-3-yl]ethan-1-one
Molecular Weight: 463.92
Molecular Formula: C25 H22 Cl N3 O4
Smiles: CCOc1ccc(cc1)N1C(c2ccc3c(c2)OCO3)N(c2ccc(cc2)[Cl])N=C1C(C)=O
Stereo: RACEMIC MIXTURE
logP: 5.9742
logD: 5.9742
logSw: -6.3241
Hydrogen bond acceptors count: 6
Polar surface area: 54.922
InChI Key: MNIUNTIYBRXBBA-VWLOTQADSA-N
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