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N-[2-(3,4-dichlorophenyl)-1,3-benzoxazol-5-yl]-3,5-dimethoxybenzamide

N-[2-(3,4-dichlorophenyl)-1,3-benzoxazol-5-yl]-3,5-dimethoxybenzamide

Formula: C22H16Cl2N2O4

SMILES: COC1=CC(=CC(OC)=C1)C(=O)NC1=CC=C2OC(=NC2=C1)C1=CC=C(Cl)C(Cl)=C1

IUPAC: N-[2-(3,4-dichlorophenyl)-1,3-benzoxazol-5-yl]-3,5-dimethoxybenzamide

InChI: InChI=1S/C22H16Cl2N2O4/c1-28-15-7-13(8-16(11-15)29-2)21(27)25-14-4-6-20-19(10-14)26-22(30-20)12-3-5-17(23)18(24)9-12/h3-11H,1-2H3,(H,25,27)

Composition: C (59.61%), H (3.64%), Cl (15.99%), N (6.32%), O (14.44%)

Molar Mass: 443.28

Atom Count: 46

Heavy Atom Count: 30

Properties
Properties
Common Names N/A
Aromatic Ring Count 4
Asymmetric Atom Count 0
Exact Mass 442.0487124
Formal Charge 0
FSP3 0.09
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey NQDHUILIFPFTIR-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 125.89
Topological Polar Surface Area 73.59
Polarizability 45.52
Ring Count 4
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 C22H16Cl2N2O4 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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