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Home > Imidazoles > 89334-78-1
89334-78-1 | 4-Thiazolidinone, 3-(1H-benzimidazol-2-ylmethyl)-2-(phenylimino)-
CAS No: 89334-78-1 Catalog No: AG003ZGP MDL No:
Product Description
Catalog Number:
AG003ZGP
Chemical Name:
4-Thiazolidinone, 3-(1H-benzimidazol-2-ylmethyl)-2-(phenylimino)-
CAS Number:
89334-78-1
Molecular Formula:
C17H14N4OS
Molecular Weight:
322.3843
IUPAC Name:
3-(1H-benzimidazol-2-ylmethyl)-2-phenylimino-1,3-thiazolidin-4-one
InChI:
InChI=1S/C17H14N4OS/c22-16-11-23-17(18-12-6-2-1-3-7-12)21(16)10-15-19-13-8-4-5-9-14(13)20-15/h1-9H,10-11H2,(H,19,20)
InChI Key:
LLVHNHRAWNLOAH-UHFFFAOYSA-N
SMILES:
O=C1CSC(=Nc2ccccc2)N1Cc1nc2c([nH]1)cccc2
Properties
Complexity:
477
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
322.089g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
322.386g/mol
Monoisotopic Mass:
322.089g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
86.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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