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(5E)-1-(4-fluorophenyl)-5-{[5-(3-nitrophenyl)furan-2-yl]methylidene}-1,3-diazinane-2,4,6-trione

(5E)-1-(4-fluorophenyl)-5-{[5-(3-nitrophenyl)furan-2-yl]methylidene}-1,3-diazinane-2,4,6-trione

Formula: C21H12FN3O6

SMILES: [O-][N+](=O)C1=CC(=CC=C1)C1=CC=C(O1)C=C1/C(=O)NC(=O)N(C1=O)C1=CC=C(F)C=C1

IUPAC: (5E)-1-(4-fluorophenyl)-5-{[5-(3-nitrophenyl)furan-2-yl]methylidene}-1,3-diazinane-2,4,6-trione

InChI: InChI=1S/C21H12FN3O6/c22-13-4-6-14(7-5-13)24-20(27)17(19(26)23-21(24)28)11-16-8-9-18(31-16)12-2-1-3-15(10-12)25(29)30/h1-11H,(H,23,26,28)/b17-11+

Composition: C (59.86%), H (2.87%), F (4.51%), N (9.97%), O (22.78%)

Molar Mass: 421.34

Atom Count: 43

Heavy Atom Count: 31

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 421.071013281
Formal Charge 0
FSP3 0
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 1
InChIKey WMOQBRXGASKQIG-GZTJUZNOSA-N
Lipinski's Rule of Five 1
Molar Refractivity 104.74
Topological Polar Surface Area 122.76
Polarizability 40.07
Ring Count 4
Rotatable Bond Count 4

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Purity (%)
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Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C21H12FN3O6 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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