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(5E)-1-cyclohexyl-5-{[3-ethoxy-4-methoxy-5-(prop-2-en-1-yl)phenyl]methylidene}-1,3-diazinane-2,4,6-trione

(5E)-1-cyclohexyl-5-{[3-ethoxy-4-methoxy-5-(prop-2-en-1-yl)phenyl]methylidene}-1,3-diazinane-2,4,6-trione

Formula: C23H28N2O5

SMILES: CCOC1=CC(C=C2/C(=O)NC(=O)N(C3CCCCC3)C2=O)=CC(CC=C)=C1OC

IUPAC: (5E)-1-cyclohexyl-5-{[3-ethoxy-4-methoxy-5-(prop-2-en-1-yl)phenyl]methylidene}-1,3-diazinane-2,4,6-trione

InChI: InChI=1S/C23H28N2O5/c1-4-9-16-12-15(14-19(30-5-2)20(16)29-3)13-18-21(26)24-23(28)25(22(18)27)17-10-7-6-8-11-17/h4,12-14,17H,1,5-11H2,2-3H3,(H,24,26,28)/b18-13+

Composition: C (66.97%), H (6.84%), N (6.79%), O (19.39%)

Molar Mass: 412.486

Atom Count: 58

Heavy Atom Count: 30

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 412.19982201
Formal Charge 0
FSP3 0.43
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 1
InChIKey JVKSZUVXOUXSTN-QGOAFFKASA-N
Lipinski's Rule of Five 1
Molar Refractivity 113.99
Topological Polar Surface Area 84.94
Polarizability 43.55
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 C23H28N2O5 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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