2-{4-[(4-methylbenzene-1-sulfonyl)imino]-1,3,5-triazinan-1-yl}ethyl benzoate

Chemical Structure Depiction of
2-{4-[(4-methylbenzene-1-sulfonyl)imino]-1,3,5-triazinan-1-yl}ethyl benzoate
Available: 120 mg
Amount:
mg
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Compound characteristics

Compound ID: 2812-0087
Compound Name: 2-{4-[(4-methylbenzene-1-sulfonyl)imino]-1,3,5-triazinan-1-yl}ethyl benzoate
Molecular Weight: 402.47
Molecular Formula: C19 H22 N4 O4 S
Smiles: Cc1ccc(cc1)S(N=C1NCN(CCOC(c2ccccc2)=O)CN1)(=O)=O
Stereo: ACHIRAL
logP: 2.6338
logD: 2.5877
logSw: -2.9259
Hydrogen bond acceptors count: 9
Hydrogen bond donors count: 2
Polar surface area: 84.753
InChI Key: GEFUEZFPBVDOQE-UHFFFAOYSA-N
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