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N-(4-ethoxyphenyl)-4-(methylsulfanyl)-N-({N'-[(E)-[5-(4-nitrophenyl)furan-2-yl]methylidene]hydrazinecarbonyl}methyl)benzenesulfonamide

N-(4-ethoxyphenyl)-4-(methylsulfanyl)-N-({N'-[(E)-[5-(4-nitrophenyl)furan-2-yl]methylidene]hydrazinecarbonyl}methyl)benzenesulfonamide

Formula: C28H26N4O7S2

SMILES: CCOC1=CC=C(C=C1)N(CC(=O)NN=CC1=CC=C(O1)C1=CC=C(C=C1)[N+]([O-])=O)S(=O)(=O)C1=CC=C(SC)C=C1

IUPAC: N-(4-ethoxyphenyl)-4-(methylsulfanyl)-N-({N'-[(E)-[5-(4-nitrophenyl)furan-2-yl]methylidene]hydrazinecarbonyl}methyl)benzene-1-sulfonamide

InChI: InChI=1S/C28H26N4O7S2/c1-3-38-23-10-8-21(9-11-23)31(41(36,37)26-15-13-25(40-2)14-16-26)19-28(33)30-29-18-24-12-17-27(39-24)20-4-6-22(7-5-20)32(34)35/h4-18H,3,19H2,1-2H3,(H,30,33)/b29-18+

Composition: C (56.55%), H (4.41%), N (9.42%), O (18.83%), S (10.78%)

Molar Mass: 594.66

Atom Count: 67

Heavy Atom Count: 41

Properties
Properties
Common Names N/A
Aromatic Ring Count 4
Asymmetric Atom Count 0
Exact Mass 594.124291541
Formal Charge 0
FSP3 0.14
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 7
Hydrogen Bond Donor Count 1
InChIKey PBFMARQDYDCNNV-RDRPBHBLSA-N
Lipinski's Rule of Five
Molar Refractivity 156.49
Topological Polar Surface Area 144.35
Polarizability 61.18
Ring Count 4
Rotatable Bond Count 11

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Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C28H26N4O7S2 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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