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N-({N'-[(E)-2H-1,3-benzodioxol-5-ylmethylidene]hydrazinecarbonyl}methyl)-2,4-dichlorobenzamide

N-({N'-[(E)-2H-1,3-benzodioxol-5-ylmethylidene]hydrazinecarbonyl}methyl)-2,4-dichlorobenzamide

Formula: C17H13Cl2N3O4

SMILES: ClC1=CC=C(C(=O)NCC(=O)NN=CC2=CC=C3OCOC3=C2)C(Cl)=C1

IUPAC: N-({N'-[(E)-(2H-1,3-benzodioxol-5-yl)methylidene]hydrazinecarbonyl}methyl)-2,4-dichlorobenzamide

InChI: InChI=1S/C17H13Cl2N3O4/c18-11-2-3-12(13(19)6-11)17(24)20-8-16(23)22-21-7-10-1-4-14-15(5-10)26-9-25-14/h1-7H,8-9H2,(H,20,24)(H,22,23)/b21-7+

Composition: C (51.80%), H (3.32%), Cl (17.99%), N (10.66%), O (16.23%)

Molar Mass: 394.21

Atom Count: 39

Heavy Atom Count: 26

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 393.0283113
Formal Charge 0
FSP3 0.12
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 2
InChIKey VAXPTHCNIUNWFW-QPSGOUHRSA-N
Lipinski's Rule of Five 1
Molar Refractivity 96.42
Topological Polar Surface Area 89.02
Polarizability 36.59
Ring Count 3
Rotatable Bond Count 5

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Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C17H13Cl2N3O4 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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