4-(benzenesulfonyl)-1-tert-butyl-3-methyl-1H-pyrazol-5-yl 2-methyl-3-nitrobenzoate

Chemical Structure Depiction of
4-(benzenesulfonyl)-1-tert-butyl-3-methyl-1H-pyrazol-5-yl 2-methyl-3-nitrobenzoate
Available: 189 mg
Amount:
mg
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Compound characteristics

Compound ID: C263-0069
Compound Name: 4-(benzenesulfonyl)-1-tert-butyl-3-methyl-1H-pyrazol-5-yl 2-methyl-3-nitrobenzoate
Molecular Weight: 457.5
Molecular Formula: C22 H23 N3 O6 S
Smiles: Cc1c(cccc1[N+]([O-])=O)C(=O)Oc1c(c(C)nn1C(C)(C)C)S(c1ccccc1)(=O)=O
Stereo: ACHIRAL
logP: 3.8888
logD: 3.8888
logSw: -4.2352
Hydrogen bond acceptors count: 12
Polar surface area: 98.098
InChI Key: DTBUAHNRSKJJRS-UHFFFAOYSA-N
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