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N-(1-{N'-[(E)-(5-bromo-2-hydroxyphenyl)methylidene]hydrazinecarbonyl}ethyl)-2-(naphthalen-2-yloxy)acetamide

N-(1-{N'-[(E)-(5-bromo-2-hydroxyphenyl)methylidene]hydrazinecarbonyl}ethyl)-2-(naphthalen-2-yloxy)acetamide

Formula: C22H20BrN3O4

SMILES: CC(NC(=O)COC1=CC2=CC=CC=C2C=C1)C(=O)NN=CC1=CC(Br)=CC=C1O

IUPAC: N-(1-{N'-[(E)-(5-bromo-2-hydroxyphenyl)methylidene]hydrazinecarbonyl}ethyl)-2-(naphthalen-2-yloxy)acetamide

InChI: InChI=1/C22H20BrN3O4/c1-14(22(29)26-24-12-17-10-18(23)7-9-20(17)27)25-21(28)13-30-19-8-6-15-4-2-3-5-16(15)11-19/h2-12,14,27H,13H2,1H3,(H,25,28)(H,26,29)/b24-12+

Composition: C (56.18%), H (4.29%), Br (16.99%), N (8.93%), O (13.61%)

Molar Mass: 470.323

Atom Count: 50

Heavy Atom Count: 30

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 1
Exact Mass 469.063719
Formal Charge 0
FSP3 0.14
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 3
InChIKey HCHJPRZFNATGBQ-WYMPLXKRNA-N
Lipinski's Rule of Five 1
Molar Refractivity 116.88
Topological Polar Surface Area 100.02
Polarizability 45.61
Ring Count 3
Rotatable Bond Count 7

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Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C22H20BrN3O4 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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