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2-({2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]diazen-1-yl}methyl)phenyl benzenesulfonate

2-({2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]diazen-1-yl}methyl)phenyl benzenesulfonate

Formula: C22H16N4O5S2

SMILES: [O-][N+](=O)C1=CC=C(C=C1)C1=CSC(N=NCC2=CC=CC=C2OS(=O)(=O)C2=CC=CC=C2)=N1

IUPAC: 2-({2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]diazen-1-yl}methyl)phenyl benzenesulfonate

InChI: InChI=1S/C22H16N4O5S2/c27-26(28)18-12-10-16(11-13-18)20-15-32-22(24-20)25-23-14-17-6-4-5-9-21(17)31-33(29,30)19-7-2-1-3-8-19/h1-13,15H,14H2

Composition: C (54.99%), H (3.36%), N (11.66%), O (16.65%), S (13.34%)

Molar Mass: 480.51

Atom Count: 49

Heavy Atom Count: 33

Properties
Properties
Common Names N/A
Aromatic Ring Count 4
Asymmetric Atom Count 0
Exact Mass 480.056211979
Formal Charge 0
FSP3 0.05
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 7
Hydrogen Bond Donor Count 0
InChIKey GVVWLDFAMOWWDP-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 123.85
Topological Polar Surface Area 124.12
Polarizability 48.46
Ring Count 4
Rotatable Bond Count 8

Suppliers

Purity (%)
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Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C22H16N4O5S2 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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