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N-({N'-[(E)-(2-chloroquinolin-3-yl)methylidene]hydrazinecarbonyl}methyl)-N-(2-methylphenyl)benzenesulfonamide

N-({N'-[(E)-(2-chloroquinolin-3-yl)methylidene]hydrazinecarbonyl}methyl)-N-(2-methylphenyl)benzenesulfonamide

Formula: C25H21ClN4O3S

SMILES: CC1=CC=CC=C1N(CC(=O)NN=CC1=CC2=CC=CC=C2N=C1Cl)S(=O)(=O)C1=CC=CC=C1

IUPAC: N-({N'-[(E)-(2-chloroquinolin-3-yl)methylidene]hydrazinecarbonyl}methyl)-N-(2-methylphenyl)benzenesulfonamide

InChI: InChI=1S/C25H21ClN4O3S/c1-18-9-5-8-14-23(18)30(34(32,33)21-11-3-2-4-12-21)17-24(31)29-27-16-20-15-19-10-6-7-13-22(19)28-25(20)26/h2-16H,17H2,1H3,(H,29,31)/b27-16+

Composition: C (60.91%), H (4.29%), Cl (7.19%), N (11.37%), O (9.74%), S (6.50%)

Molar Mass: 492.98

Atom Count: 55

Heavy Atom Count: 34

Properties
Properties
Common Names N/A
Aromatic Ring Count 4
Asymmetric Atom Count 0
Exact Mass 492.1022894
Formal Charge 0
FSP3 0.08
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 1
InChIKey PQLZQAQDPKJCOR-JVWAILMASA-N
Lipinski's Rule of Five 1
Molar Refractivity 133.62
Topological Polar Surface Area 91.73
Polarizability 52.54
Ring Count 4
Rotatable Bond Count 6

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Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C25H21ClN4O3S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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