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77303-41-4 | 1,2,4-Thiadiazolidin-3-one, 2,4-diphenyl-5-(phenylimino)-
CAS No: 77303-41-4 Catalog No: AG0054RU MDL No:
Product Description
Catalog Number:
AG0054RU
Chemical Name:
1,2,4-Thiadiazolidin-3-one, 2,4-diphenyl-5-(phenylimino)-
CAS Number:
77303-41-4
Molecular Formula:
C20H15N3OS
Molecular Weight:
345.4176
IUPAC Name:
2,4-diphenyl-5-phenylimino-1,2,4-thiadiazolidin-3-one
InChI:
InChI=1S/C20H15N3OS/c24-20-22(17-12-6-2-7-13-17)19(21-16-10-4-1-5-11-16)25-23(20)18-14-8-3-9-15-18/h1-15H
InChI Key:
DGJGVNWJLYOHDG-UHFFFAOYSA-N
SMILES:
O=c1n(sc(=Nc2ccccc2)n1c1ccccc1)c1ccccc1
Properties
Complexity:
491
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
345.094g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
345.42g/mol
Monoisotopic Mass:
345.094g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
61.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5
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