N-(2,6-dimethylphenyl)-2-({4-methyl-5-[1-(3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)ethyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide

Chemical Structure Depiction of
N-(2,6-dimethylphenyl)-2-({4-methyl-5-[1-(3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)ethyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Available: 181 mg
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mg
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Compound characteristics

Compound ID: J039-0008
Compound Name: N-(2,6-dimethylphenyl)-2-({4-methyl-5-[1-(3-oxo-2,3-dihydro-4H-1,4-benzoxazin-4-yl)ethyl]-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Molecular Weight: 451.55
Molecular Formula: C23 H25 N5 O3 S
Smiles: CC(c1nnc(n1C)SCC(Nc1c(C)cccc1C)=O)N1C(COc2ccccc12)=O
Stereo: RACEMIC MIXTURE
logP: 2.2171
logD: 2.2171
logSw: -2.5717
Hydrogen bond acceptors count: 8
Hydrogen bond donors count: 1
Polar surface area: 70.247
InChI Key: CYNNWHNMOPMISF-INIZCTEOSA-N
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