2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[2-(4-methylphenyl)ethyl]-5-nitro-3-oxo-2H-1,2,3lambda~5~-triazol-4-amine

Chemical Structure Depiction of
2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[2-(4-methylphenyl)ethyl]-5-nitro-3-oxo-2H-1,2,3lambda~5~-triazol-4-amine
Available: 79 mg
Amount:
mg
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Compound characteristics

Compound ID: C437-0131
Compound Name: 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[2-(4-methylphenyl)ethyl]-5-nitro-3-oxo-2H-1,2,3lambda~5~-triazol-4-amine
Molecular Weight: 397.39
Molecular Formula: C19 H19 N5 O5
Smiles: Cc1ccc(CCNc2c(nn(c3ccc4c(c3)OCCO4)[n+]2[O-])[N+]([O-])=O)cc1
Stereo: ACHIRAL
logP: 2.4105
logD: 2.4105
logSw: -2.6639
Hydrogen bond acceptors count: 9
Hydrogen bond donors count: 1
Polar surface area: 93.07
InChI Key: LECHKFKINQZJFM-UHFFFAOYSA-N
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