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N-(2-chlorophenyl)-N-({N'-[(1E)-1-(3-nitrophenyl)ethylidene]hydrazinecarbonyl}methyl)methanesulfonamide

N-(2-chlorophenyl)-N-({N'-[(1E)-1-(3-nitrophenyl)ethylidene]hydrazinecarbonyl}methyl)methanesulfonamide

Formula: C17H17ClN4O5S

SMILES: CC(=N/NC(=O)CN(C1=CC=CC=C1Cl)S(C)(=O)=O)C1=CC=CC(=C1)[N+]([O-])=O

IUPAC: N-(2-chlorophenyl)-N-({N'-[(1E)-1-(3-nitrophenyl)ethylidene]hydrazinecarbonyl}methyl)methanesulfonamide

InChI: InChI=1S/C17H17ClN4O5S/c1-12(13-6-5-7-14(10-13)22(24)25)19-20-17(23)11-21(28(2,26)27)16-9-4-3-8-15(16)18/h3-10H,11H2,1-2H3,(H,20,23)/b19-12+

Composition: C (48.06%), H (4.03%), Cl (8.34%), N (13.19%), O (18.83%), S (7.55%)

Molar Mass: 424.86

Atom Count: 45

Heavy Atom Count: 28

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 424.0608185
Formal Charge 0
FSP3 0.18
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 6
Hydrogen Bond Donor Count 1
InChIKey FXJKSGJJFVMMRA-XDHOZWIPSA-N
Lipinski's Rule of Five 1
Molar Refractivity 103.59
Topological Polar Surface Area 121.98
Polarizability 40.24
Ring Count 2
Rotatable Bond Count 6

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C17H17ClN4O5S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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