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113657-10-6 | 1,3,4-Oxadiazole-2(3H)-thione, 5-[2-(4-morpholinyl)ethyl]-
CAS No: 113657-10-6 Catalog No: AG000981 MDL No:
Product Description
Catalog Number:
AG000981
Chemical Name:
1,3,4-Oxadiazole-2(3H)-thione, 5-[2-(4-morpholinyl)ethyl]-
CAS Number:
113657-10-6
Molecular Formula:
C8H13N3O2S
Molecular Weight:
215.2727
IUPAC Name:
5-(2-morpholin-4-ylethyl)-3H-1,3,4-oxadiazole-2-thione
InChI:
InChI=1S/C8H13N3O2S/c14-8-10-9-7(13-8)1-2-11-3-5-12-6-4-11/h1-6H2,(H,10,14)
InChI Key:
MYWKPPDQQJGWIZ-UHFFFAOYSA-N
SMILES:
S=c1[nH]nc(o1)CCN1CCOCC1
Properties
Complexity:
251
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.073g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
215.271g/mol
Monoisotopic Mass:
215.073g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
78.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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