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2-(4-ethoxyphenyl)-4-[4-(4-nitrophenyl)piperazine-1-carbonyl]quinoline

2-(4-ethoxyphenyl)-4-[4-(4-nitrophenyl)piperazine-1-carbonyl]quinoline

Formula: C28H26N4O4

SMILES: CCOC1=CC=C(C=C1)C1=NC2=CC=CC=C2C(=C1)C(=O)N1CCN(CC1)C1=CC=C(C=C1)[N+]([O-])=O

IUPAC: 2-(4-ethoxyphenyl)-4-[4-(4-nitrophenyl)piperazine-1-carbonyl]quinoline

InChI: InChI=1S/C28H26N4O4/c1-2-36-23-13-7-20(8-14-23)27-19-25(24-5-3-4-6-26(24)29-27)28(33)31-17-15-30(16-18-31)21-9-11-22(12-10-21)32(34)35/h3-14,19H,2,15-18H2,1H3

Composition: C (69.70%), H (5.43%), N (11.61%), O (13.26%)

Molar Mass: 482.54

Atom Count: 62

Heavy Atom Count: 36

Properties
Properties
Common Names N/A
Aromatic Ring Count 4
Asymmetric Atom Count 0
Exact Mass 482.195405333
Formal Charge 0
FSP3 0.21
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 6
Hydrogen Bond Donor Count 0
InChIKey UFMFZWUTXUFOKB-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 137.7
Topological Polar Surface Area 88.81
Polarizability 54.32
Ring Count 5
Rotatable Bond Count 6

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C28H26N4O4 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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