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2-[3-(4-methanesulfinylphenyl)-1-benzofuran-5-yl]-5-methyl-1,3,4-oxadiazole

2-[3-(4-methanesulfinylphenyl)-1-benzofuran-5-yl]-5-methyl-1,3,4-oxadiazole

CAS: 1005203-15-5

Formula: C18H14N2O3S

SMILES: CC1=NN=C(O1)C1=CC=C2OC=C(C2=C1)C1=CC=C(C=C1)S(C)=O

IUPAC: 2-[3-(4-methanesulfinylphenyl)-1-benzofuran-5-yl]-5-methyl-1,3,4-oxadiazole

InChI: InChI=1/C18H14N2O3S/c1-11-19-20-18(23-11)13-5-8-17-15(9-13)16(10-22-17)12-3-6-14(7-4-12)24(2)21/h3-10H,1-2H3

Composition: C (63.89%), H (4.17%), N (8.28%), O (14.18%), S (9.47%)

Molar Mass: 338.38

Atom Count: 38

Heavy Atom Count: 24

Properties
Properties
Common Names N/A
Aromatic Ring Count 4
Asymmetric Atom Count 1
Exact Mass 338.072513493
Formal Charge 0
FSP3 0.11
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey RCKYSTKYIVULEK-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 104.86
Topological Polar Surface Area 69.13
Polarizability 38.27
Ring Count 4
Rotatable Bond Count 3

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98% <4 Days 1005203-15-5 $185.18$185.18
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