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3-(2-bromophenyl)-5-(4-chlorophenyl)-1,2,4-oxadiazole

3-(2-bromophenyl)-5-(4-chlorophenyl)-1,2,4-oxadiazole

CAS: 425373-64-4

Formula: C14H8BrClN2O

SMILES: ClC1=CC=C(C=C1)C1=NC(=NO1)C1=CC=CC=C1Br

IUPAC: 3-(2-bromophenyl)-5-(4-chlorophenyl)-1,2,4-oxadiazole

InChI: InChI=1S/C14H8BrClN2O/c15-12-4-2-1-3-11(12)13-17-14(19-18-13)9-5-7-10(16)8-6-9/h1-8H

Composition: C (50.11%), H (2.40%), Br (23.81%), Cl (10.56%), N (8.35%), O (4.77%)

Molar Mass: 335.59

Atom Count: 27

Heavy Atom Count: 19

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 333.950854
Formal Charge 0
FSP3 0
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey UZPFCJFMWDPDJT-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 99.61
Topological Polar Surface Area 38.92
Polarizability 30.62
Ring Count 3
Rotatable Bond Count 2

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