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N-[(4-chlorophenyl)methyl]-3-[(3-hydroxynaphthalen-2-yl)formohydrazido]but-2-enamide

N-[(4-chlorophenyl)methyl]-3-[(3-hydroxynaphthalen-2-yl)formohydrazido]but-2-enamide

Formula: C22H20ClN3O3

SMILES: CC(NNC(=O)C1=CC2=CC=CC=C2C=C1O)=CC(=O)NCC1=CC=C(Cl)C=C1

IUPAC: N-[(4-chlorophenyl)methyl]-3-[(3-hydroxynaphthalen-2-yl)formohydrazido]but-2-enamide

InChI: InChI=1S/C22H20ClN3O3/c1-14(10-21(28)24-13-15-6-8-18(23)9-7-15)25-26-22(29)19-11-16-4-2-3-5-17(16)12-20(19)27/h2-12,25,27H,13H2,1H3,(H,24,28)(H,26,29)

Composition: C (64.47%), H (4.92%), Cl (8.65%), N (10.25%), O (11.71%)

Molar Mass: 409.87

Atom Count: 49

Heavy Atom Count: 29

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 409.1193192
Formal Charge 0
FSP3 0.09
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 4
InChIKey RGLCYHJHPJGYPR-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 125.34
Topological Polar Surface Area 90.46
Polarizability 44.03
Ring Count 3
Rotatable Bond Count 6

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Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C22H20ClN3O3 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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