4-[(2,6-dibromo-4-{[1-(4-tert-butylphenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl}phenoxy)methyl]benzoic acid

Chemical Structure Depiction of
4-[(2,6-dibromo-4-{[1-(4-tert-butylphenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl}phenoxy)methyl]benzoic acid
Available: 1721 mg
Amount:
mg
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Compound characteristics

Compound ID: 2817-0691
Compound Name: 4-[(2,6-dibromo-4-{[1-(4-tert-butylphenyl)-2,4,6-trioxo-1,3-diazinan-5-ylidene]methyl}phenoxy)methyl]benzoic acid
Molecular Weight: 656.33
Molecular Formula: C29 H24 Br2 N2 O6
Smiles: CC(C)(C)c1ccc(cc1)N1C(C(=C\c2cc(c(c(c2)[Br])OCc2ccc(cc2)C(O)=O)[Br])\C(NC1=O)=O)=O
Stereo: ACHIRAL
logP: 6.8161
logD: 3.8446
logSw: -5.4999
Hydrogen bond acceptors count: 10
Hydrogen bond donors count: 2
Polar surface area: 89.2
InChI Key: KOPWLCNXSGUHTO-UHFFFAOYSA-N
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