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

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

CAS: 957065-98-4

Formula: C14H15BrN2O

SMILES: BrC1=CC=CC(=C1)C1=NN=C(O1)C1CCCCC1

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

InChI: InChI=1S/C14H15BrN2O/c15-12-8-4-7-11(9-12)14-17-16-13(18-14)10-5-2-1-3-6-10/h4,7-10H,1-3,5-6H2

Composition: C (54.74%), H (4.92%), Br (26.01%), N (9.12%), O (5.21%)

Molar Mass: 307.191

Atom Count: 33

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	306.036776
Formal Charge	0
FSP3	0.43
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	AALHXJNIVDMMFQ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	85.35
Topological Polar Surface Area	38.92
Polarizability	28.7
Ring Count	3
Rotatable Bond Count	2

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