1-benzyl-4-(3-methoxybenzene-1-sulfonyl)-2-(3-methyl-1H-1,2,4-triazol-5-yl)-1,4-diazepane

Chemical Structure Depiction of
1-benzyl-4-(3-methoxybenzene-1-sulfonyl)-2-(3-methyl-1H-1,2,4-triazol-5-yl)-1,4-diazepane
Available: 8 mg
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mg
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Compound characteristics

Compound ID: SA53-0243
Compound Name: 1-benzyl-4-(3-methoxybenzene-1-sulfonyl)-2-(3-methyl-1H-1,2,4-triazol-5-yl)-1,4-diazepane
Molecular Weight: 441.55
Molecular Formula: C22 H27 N5 O3 S
Smiles: Cc1nc(C2CN(CCCN2Cc2ccccc2)S(c2cccc(c2)OC)(=O)=O)[nH]n1
Stereo: RACEMIC MIXTURE
logP: 2.6277
logD: 2.627
logSw: -3.0949
Hydrogen bond acceptors count: 9
Hydrogen bond donors count: 1
Polar surface area: 76.555
InChI Key: VFCPSQMHVXOHCI-NRFANRHFSA-N
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