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17883-57-7 | 1,3,4-Thiadiazol-2(3H)-one, 3-phenyl-5-(2-phenyldiazenyl)-
CAS No: 17883-57-7 Catalog No: AG0026EQ MDL No:
Product Description
Catalog Number:
AG0026EQ
Chemical Name:
1,3,4-Thiadiazol-2(3H)-one, 3-phenyl-5-(2-phenyldiazenyl)-
CAS Number:
17883-57-7
Molecular Formula:
C14H10N4OS
Molecular Weight:
282.3204
IUPAC Name:
3-phenyl-5-phenyldiazenyl-1,3,4-thiadiazol-2-one
InChI:
InChI=1S/C14H10N4OS/c19-14-18(12-9-5-2-6-10-12)17-13(20-14)16-15-11-7-3-1-4-8-11/h1-10H
InChI Key:
INGRSNVOVGHHJA-UHFFFAOYSA-N
SMILES:
O=c1sc(nn1c1ccccc1)N=Nc1ccccc1
NSC Number:
147741
Properties
Complexity:
411
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.058g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
282.321g/mol
Monoisotopic Mass:
282.058g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
82.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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