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N-(2-bromophenyl)-N-({N'-[(2E)-4-phenylbutan-2-ylidene]hydrazinecarbonyl}methyl)methanesulfonamide

N-(2-bromophenyl)-N-({N'-[(2E)-4-phenylbutan-2-ylidene]hydrazinecarbonyl}methyl)methanesulfonamide

Formula: C19H22BrN3O3S

SMILES: CC(CCC1=CC=CC=C1)=N/NC(=O)CN(C1=CC=CC=C1Br)S(C)(=O)=O

IUPAC: N-(2-bromophenyl)-N-({N'-[(2E)-4-phenylbutan-2-ylidene]hydrazinecarbonyl}methyl)methanesulfonamide

InChI: InChI=1S/C19H22BrN3O3S/c1-15(12-13-16-8-4-3-5-9-16)21-22-19(24)14-23(27(2,25)26)18-11-7-6-10-17(18)20/h3-11H,12-14H2,1-2H3,(H,22,24)/b21-15+

Composition: C (50.45%), H (4.90%), Br (17.66%), N (9.29%), O (10.61%), S (7.09%)

Molar Mass: 452.37

Atom Count: 49

Heavy Atom Count: 27

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 451.056526
Formal Charge 0
FSP3 0.26
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey JOQCBXDNIJJLQP-RCCKNPSSSA-N
Lipinski's Rule of Five 1
Molar Refractivity 109.14
Topological Polar Surface Area 78.84
Polarizability 42.77
Ring Count 2
Rotatable Bond Count 7

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C19H22BrN3O3S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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