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5-{[3-methoxy-4-(2-phenoxyethoxy)phenyl]methylidene}-1,3-diazinane-2,4,6-trione

5-{[3-methoxy-4-(2-phenoxyethoxy)phenyl]methylidene}-1,3-diazinane-2,4,6-trione

Formula: C20H18N2O6

SMILES: COC1=CC(C=C2C(=O)NC(=O)NC2=O)=CC=C1OCCOC1=CC=CC=C1

IUPAC: 5-{[3-methoxy-4-(2-phenoxyethoxy)phenyl]methylidene}-1,3-diazinane-2,4,6-trione

InChI: InChI=1S/C20H18N2O6/c1-26-17-12-13(11-15-18(23)21-20(25)22-19(15)24)7-8-16(17)28-10-9-27-14-5-3-2-4-6-14/h2-8,11-12H,9-10H2,1H3,(H2,21,22,23,24,25)

Composition: C (62.82%), H (4.75%), N (7.33%), O (25.10%)

Molar Mass: 382.372

Atom Count: 46

Heavy Atom Count: 28

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 382.116486308
Formal Charge 0
FSP3 0.15
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 6
Hydrogen Bond Donor Count 2
InChIKey DCZIHHFPRRRVEO-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 99.6
Topological Polar Surface Area 102.96
Polarizability 38.26
Ring Count 3
Rotatable Bond Count 7

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Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C20H18N2O6 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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