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(5Z)-1-(4-bromophenyl)-5-({3-chloro-5-methoxy-4-[(3-methylphenyl)methoxy]phenyl}methylidene)-1,3-diazinane-2,4,6-trione

(5Z)-1-(4-bromophenyl)-5-({3-chloro-5-methoxy-4-[(3-methylphenyl)methoxy]phenyl}methylidene)-1,3-diazinane-2,4,6-trione

Formula: C26H20BrClN2O5

SMILES: COC1=CC(C=C2C(=O)NC(=O)N(C2=O)C2=CC=C(Br)C=C2)=CC(Cl)=C1OCC1=CC=CC(C)=C1

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

InChI: InChI=1S/C26H20BrClN2O5/c1-15-4-3-5-16(10-15)14-35-23-21(28)12-17(13-22(23)34-2)11-20-24(31)29-26(33)30(25(20)32)19-8-6-18(27)7-9-19/h3-13H,14H2,1-2H3,(H,29,31,33)/b20-11-

Composition: C (56.19%), H (3.63%), Br (14.38%), Cl (6.38%), N (5.04%), O (14.39%)

Molar Mass: 555.81

Atom Count: 55

Heavy Atom Count: 35

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 554.024412
Formal Charge 0
FSP3 0.12
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 1
InChIKey QMRMTLFMLNSPJK-JAIQZWGSSA-N
Lipinski's Rule of Five
Molar Refractivity 135.8
Topological Polar Surface Area 84.94
Polarizability 51.74
Ring Count 4
Rotatable Bond Count 6

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Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C26H20BrClN2O5 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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