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(2E)-N-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-2-cyano-3-(4-nitrophenyl)prop-2-enamide

(2E)-N-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-2-cyano-3-(4-nitrophenyl)prop-2-enamide

Formula: C19H11ClN4O3S

SMILES: [O-][N+](=O)C1=CC=C(C=C(/C#N)C(=O)NC2=NC(=CS2)C2=CC=C(Cl)C=C2)C=C1

IUPAC: (2E)-N-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-2-cyano-3-(4-nitrophenyl)prop-2-enamide

InChI: InChI=1S/C19H11ClN4O3S/c20-15-5-3-13(4-6-15)17-11-28-19(22-17)23-18(25)14(10-21)9-12-1-7-16(8-2-12)24(26)27/h1-9,11H,(H,22,23,25)/b14-9+

Composition: C (55.55%), H (2.70%), Cl (8.63%), N (13.64%), O (11.68%), S (7.80%)

Molar Mass: 410.83

Atom Count: 39

Heavy Atom Count: 28

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 410.0240391
Formal Charge 0
FSP3 0
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 1
InChIKey ZIUIKPXXLVFRTO-NTEUORMPSA-N
Lipinski's Rule of Five
Molar Refractivity 106.96
Topological Polar Surface Area 108.92
Polarizability 40.58
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 C19H11ClN4O3S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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