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(5E)-1-(2H-1,3-benzodioxol-5-yl)-5-[(3,5-di-tert-butyl-4-hydroxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione

(5E)-1-(2H-1,3-benzodioxol-5-yl)-5-[(3,5-di-tert-butyl-4-hydroxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione

Formula: C26H28N2O6

SMILES: CC(C)(C)C1=CC(C=C2/C(=O)NC(=O)N(C2=O)C2=CC=C3OCOC3=C2)=CC(=C1O)C(C)(C)C

IUPAC: (5E)-1-(2H-1,3-benzodioxol-5-yl)-5-[(3,5-di-tert-butyl-4-hydroxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione

InChI: InChI=1S/C26H28N2O6/c1-25(2,3)17-10-14(11-18(21(17)29)26(4,5)6)9-16-22(30)27-24(32)28(23(16)31)15-7-8-19-20(12-15)34-13-33-19/h7-12,29H,13H2,1-6H3,(H,27,30,32)/b16-9+

Composition: C (67.23%), H (6.08%), N (6.03%), O (20.67%)

Molar Mass: 464.518

Atom Count: 62

Heavy Atom Count: 34

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 464.19473663
Formal Charge 0
FSP3 0.35
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 6
Hydrogen Bond Donor Count 2
InChIKey LAHLLDPIKQIOQV-CXUHLZMHSA-N
Lipinski's Rule of Five
Molar Refractivity 125.88
Topological Polar Surface Area 105.17
Polarizability 48.3
Ring Count 4
Rotatable Bond Count 4

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C26H28N2O6 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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