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102152-10-3 | 1H-Imidazole, 5-(4-methoxyphenyl)-2-(2-thienyl)-
CAS No: 102152-10-3 Catalog No: AG0006R4 MDL No:
Product Description
Catalog Number:
AG0006R4
Chemical Name:
1H-Imidazole, 5-(4-methoxyphenyl)-2-(2-thienyl)-
CAS Number:
102152-10-3
Molecular Formula:
C14H12N2OS
Molecular Weight:
256.3229
IUPAC Name:
5-(4-methoxyphenyl)-2-thiophen-2-yl-1H-imidazole
InChI:
InChI=1S/C14H12N2OS/c1-17-11-6-4-10(5-7-11)12-9-15-14(16-12)13-3-2-8-18-13/h2-9H,1H3,(H,15,16)
InChI Key:
OCRQCMKKESAJGD-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)c1cnc([nH]1)c1cccs1
Properties
Complexity:
269
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.067g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
256.323g/mol
Monoisotopic Mass:
256.067g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
66.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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