ethyl 2-{[5-methyl-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}pentanoate

Chemical Structure Depiction of
ethyl 2-{[5-methyl-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}pentanoate
Available: 1 mg
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mg
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Compound characteristics

Compound ID: V014-3611
Compound Name: ethyl 2-{[5-methyl-4-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}pentanoate
Molecular Weight: 333.45
Molecular Formula: C17 H23 N3 O2 S
Smiles: CCCC(C(=O)OCC)Sc1nnc(C)n1c1cccc(C)c1
Stereo: RACEMIC MIXTURE
logP: 3.8419
logD: 3.8418
logSw: -3.7958
Hydrogen bond acceptors count: 6
Polar surface area: 46.786
InChI Key: XEYJRJCRCGZEDX-HNNXBMFYSA-N
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