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

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

Formula: C18H15N3O7

SMILES: COC1=CC(=CC=C1C1=CC=C(O1)C=C1C(=O)N(C)C(=O)N(C)C1=O)[N+]([O-])=O

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

InChI: InChI=1S/C18H15N3O7/c1-19-16(22)13(17(23)20(2)18(19)24)9-11-5-7-14(28-11)12-6-4-10(21(25)26)8-15(12)27-3/h4-9H,1-3H3

Composition: C (56.11%), H (3.92%), N (10.91%), O (29.06%)

Molar Mass: 385.332

Atom Count: 43

Heavy Atom Count: 28

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 385.090999835
Formal Charge 0
FSP3 0.17
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 6
Hydrogen Bond Donor Count 0
InChIKey COIOZSNSQAFHIO-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 96.1
Topological Polar Surface Area 123.2
Polarizability 37.05
Ring Count 3
Rotatable Bond Count 4

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Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C18H15N3O7 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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