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(5Z)-5-({5-chloro-2-[2-(3-methylphenoxy)ethoxy]phenyl}methylidene)-1-(4-methoxyphenyl)-1,3-diazinane-2,4,6-trione

(5Z)-5-({5-chloro-2-[2-(3-methylphenoxy)ethoxy]phenyl}methylidene)-1-(4-methoxyphenyl)-1,3-diazinane-2,4,6-trione

Formula: C27H23ClN2O6

SMILES: COC1=CC=C(C=C1)N1C(=O)NC(=O)C(=CC2=CC(Cl)=CC=C2OCCOC2=CC=CC(C)=C2)C1=O

IUPAC: (5Z)-5-({5-chloro-2-[2-(3-methylphenoxy)ethoxy]phenyl}methylidene)-1-(4-methoxyphenyl)-1,3-diazinane-2,4,6-trione

InChI: InChI=1S/C27H23ClN2O6/c1-17-4-3-5-22(14-17)35-12-13-36-24-11-6-19(28)15-18(24)16-23-25(31)29-27(33)30(26(23)32)20-7-9-21(34-2)10-8-20/h3-11,14-16H,12-13H2,1-2H3,(H,29,31,33)/b23-16-

Composition: C (63.97%), H (4.57%), Cl (6.99%), N (5.53%), O (18.94%)

Molar Mass: 506.94

Atom Count: 59

Heavy Atom Count: 36

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 506.1244642
Formal Charge 0
FSP3 0.15
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 6
Hydrogen Bond Donor Count 1
InChIKey CVZQJVBFRHEPIW-KQWNVCNZSA-N
Lipinski's Rule of Five
Molar Refractivity 134.12
Topological Polar Surface Area 94.17
Polarizability 51.44
Ring Count 4
Rotatable Bond Count 8

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Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C27H23ClN2O6 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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