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(2E)-N-(1,3-benzothiazol-2-yl)-3-(2,4-dichlorophenyl)prop-2-enamide

(2E)-N-(1,3-benzothiazol-2-yl)-3-(2,4-dichlorophenyl)prop-2-enamide

Formula: C16H10Cl2N2OS

SMILES: ClC1=CC=C(C=CC(=O)NC2=NC3=CC=CC=C3S2)C(Cl)=C1

IUPAC: (2E)-N-(1,3-benzothiazol-2-yl)-3-(2,4-dichlorophenyl)prop-2-enamide

InChI: InChI=1S/C16H10Cl2N2OS/c17-11-7-5-10(12(18)9-11)6-8-15(21)20-16-19-13-3-1-2-4-14(13)22-16/h1-9H,(H,19,20,21)/b8-6+

Composition: C (55.03%), H (2.89%), Cl (20.30%), N (8.02%), O (4.58%), S (9.18%)

Molar Mass: 349.23

Atom Count: 32

Heavy Atom Count: 22

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 347.9890895
Formal Charge 0
FSP3 0
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey SQBAERYIOMMDNH-SOFGYWHQSA-N
Lipinski's Rule of Five
Molar Refractivity 91.49
Topological Polar Surface Area 41.99
Polarizability 35.45
Ring Count 3
Rotatable Bond Count 3

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C16H10Cl2N2OS $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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