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105689-15-4 | Acetamide, N-(3-phenyl-4-isothiazolyl)-
CAS No: 105689-15-4 Catalog No: AG008447 MDL No:
Product Description
Catalog Number:
AG008447
Chemical Name:
Acetamide, N-(3-phenyl-4-isothiazolyl)-
CAS Number:
105689-15-4
Molecular Formula:
C11H10N2OS
Molecular Weight:
218.2749
IUPAC Name:
N-(3-phenyl-1,2-thiazol-4-yl)acetamide
InChI:
InChI=1S/C11H10N2OS/c1-8(14)12-10-7-15-13-11(10)9-5-3-2-4-6-9/h2-7H,1H3,(H,12,14)
InChI Key:
VSGWSHLZLRQRDH-UHFFFAOYSA-N
SMILES:
CC(=O)Nc1csnc1c1ccccc1
Properties
Complexity:
229
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.051g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
218.274g/mol
Monoisotopic Mass:
218.051g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
70.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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