2-(3,4-dichlorophenyl)-5-[2-(methylsulfanyl)phenyl]-1,3,4-oxadiazole

2-(3,4-dichlorophenyl)-5-[2-(methylsulfanyl)phenyl]-1,3,4-oxadiazole

CAS: 339014-10-7

Formula: C15H10Cl2N2OS

SMILES: CSC1=C(C=CC=C1)C1=NN=C(O1)C1=CC(Cl)=C(Cl)C=C1

IUPAC: 2-(3,4-dichlorophenyl)-5-[2-(methylsulfanyl)phenyl]-1,3,4-oxadiazole

InChI: InChI=1S/C15H10Cl2N2OS/c1-21-13-5-3-2-4-10(13)15-19-18-14(20-15)9-6-7-11(16)12(17)8-9/h2-8H,1H3

Composition: C (53.43%), H (2.99%), Cl (21.02%), N (8.31%), O (4.74%), S (9.51%)

Molar Mass: 337.22

Atom Count: 31

Heavy Atom Count: 21

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	335.9890895
Formal Charge	0
FSP3	0.07
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	RSMUEVVDWZBOAM-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	109.56
Topological Polar Surface Area	38.92
Polarizability	34.65
Ring Count	3
Rotatable Bond Count	3

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