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[3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl 4-chlorobenzoate

[3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl 4-chlorobenzoate

Formula: C16H10BrClN2O3

SMILES: ClC1=CC=C(C=C1)C(=O)OCC1=NC(=NO1)C1=CC=C(Br)C=C1

IUPAC: [3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl 4-chlorobenzoate

InChI: InChI=1S/C16H10BrClN2O3/c17-12-5-1-10(2-6-12)15-19-14(23-20-15)9-22-16(21)11-3-7-13(18)8-4-11/h1-8H,9H2

Composition: C (48.82%), H (2.56%), Br (20.30%), Cl (9.01%), N (7.12%), O (12.19%)

Molar Mass: 393.62

Atom Count: 33

Heavy Atom Count: 23

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 391.956333
Formal Charge 0
FSP3 0.06
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey UYWOMSLWFSWAFN-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 100.48
Topological Polar Surface Area 65.22
Polarizability 34.48
Ring Count 3
Rotatable Bond Count 5

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Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C16H10BrClN2O3 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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