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1-[(4-methoxyphenyl)methyl]-N'-[(3Z)-7-methyl-2-oxo-1H-indol-3-ylidene]-1,2,3-triazole-4-carbohydrazide

1-[(4-methoxyphenyl)methyl]-N'-[(3Z)-7-methyl-2-oxo-1H-indol-3-ylidene]-1,2,3-triazole-4-carbohydrazide

CAS: 2271081-58-2

Formula: C20H18N6O3

SMILES: COC1=CC=C(CN2C=C(N=N2)C(=O)NN=C2/C(=O)NC3=C(C)C=CC=C23)C=C1

IUPAC: 1-[(4-methoxyphenyl)methyl]-N'-[(3Z)-7-methyl-2-oxo-2,3-dihydro-1H-indol-3-ylidene]-1H-1,2,3-triazole-4-carbohydrazide

InChI: InChI=1S/C20H18N6O3/c1-12-4-3-5-15-17(12)21-20(28)18(15)23-24-19(27)16-11-26(25-22-16)10-13-6-8-14(29-2)9-7-13/h3-9,11H,10H2,1-2H3,(H,24,27)(H,21,23,28)

Composition: C (61.53%), H (4.65%), N (21.53%), O (12.29%)

Molar Mass: 390.403

Atom Count: 47

Heavy Atom Count: 29

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 390.144038464
Formal Charge 0
FSP3 0.15
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 6
Hydrogen Bond Donor Count 2
InChIKey YYGUFPVMOAZQNZ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 119.07
Topological Polar Surface Area 110.5
Polarizability 39.24
Ring Count 4
Rotatable Bond Count 5

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Purity LeadTime CAS PacketSize UnitPrice
98% <4 Days 2271081-58-2 $282.06-$1,303.30$282.06$467.81$1,303.30
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