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

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

Formula: C25H26N2O4

SMILES: CC1=CC=C(COC2=CC=CC=C2C=C2/C(=O)NC(=O)N(C3CCCCC3)C2=O)C=C1

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

InChI: InChI=1S/C25H26N2O4/c1-17-11-13-18(14-12-17)16-31-22-10-6-5-7-19(22)15-21-23(28)26-25(30)27(24(21)29)20-8-3-2-4-9-20/h5-7,10-15,20H,2-4,8-9,16H2,1H3,(H,26,28,30)/b21-15+

Composition: C (71.75%), H (6.26%), N (6.69%), O (15.29%)

Molar Mass: 418.493

Atom Count: 57

Heavy Atom Count: 31

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 418.189257325
Formal Charge 0
FSP3 0.32
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey CTASRWCGDXERGZ-RCCKNPSSSA-N
Lipinski's Rule of Five 1
Molar Refractivity 118.15
Topological Polar Surface Area 75.71
Polarizability 45.24
Ring Count 4
Rotatable Bond Count 5

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C25H26N2O4 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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