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2227-71-6 | Thiazole, 2-(4-methoxyphenyl)-4-phenyl-
CAS No: 2227-71-6 Catalog No: AG007OYG MDL No:
Product Description
Catalog Number:
AG007OYG
Chemical Name:
Thiazole, 2-(4-methoxyphenyl)-4-phenyl-
CAS Number:
2227-71-6
Molecular Formula:
C16H13NOS
Molecular Weight:
267.3455
IUPAC Name:
2-(4-methoxyphenyl)-4-phenyl-1,3-thiazole
InChI:
InChI=1S/C16H13NOS/c1-18-14-9-7-13(8-10-14)16-17-15(11-19-16)12-5-3-2-4-6-12/h2-11H,1H3
InChI Key:
VIYMRRDTACPLHE-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)c1scc(n1)c1ccccc1
Properties
Complexity:
272
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.072g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
267.346g/mol
Monoisotopic Mass:
267.072g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
50.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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