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(2E)-N-[5-(1,3-benzoxazol-2-yl)-2-methylphenyl]-3-(2,4-dichlorophenyl)prop-2-enamide

(2E)-N-[5-(1,3-benzoxazol-2-yl)-2-methylphenyl]-3-(2,4-dichlorophenyl)prop-2-enamide

Formula: C23H16Cl2N2O2

SMILES: CC1=CC=C(C=C1NC(=O)C=CC1=CC=C(Cl)C=C1Cl)C1=NC2=CC=CC=C2O1

IUPAC: (2E)-N-[5-(1,3-benzoxazol-2-yl)-2-methylphenyl]-3-(2,4-dichlorophenyl)prop-2-enamide

InChI: InChI=1S/C23H16Cl2N2O2/c1-14-6-7-16(23-27-19-4-2-3-5-21(19)29-23)12-20(14)26-22(28)11-9-15-8-10-17(24)13-18(15)25/h2-13H,1H3,(H,26,28)/b11-9+

Composition: C (65.26%), H (3.81%), Cl (16.75%), N (6.62%), O (7.56%)

Molar Mass: 423.29

Atom Count: 45

Heavy Atom Count: 29

Properties
Properties
Common Names N/A
Aromatic Ring Count 4
Asymmetric Atom Count 0
Exact Mass 422.0588832
Formal Charge 0
FSP3 0.04
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey DZNZDOMRROICFY-PKNBQFBNSA-N
Lipinski's Rule of Five
Molar Refractivity 127.75
Topological Polar Surface Area 55.13
Polarizability 45.67
Ring Count 4
Rotatable Bond Count 4

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C23H16Cl2N2O2 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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