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150205-84-8 | 1H-IMIDAZOLE, 1-[(4-METHYLPHENYL)SULFONYL]-2-PHENYL-
CAS No: 150205-84-8 Catalog No: AG007XO8 MDL No:
Product Description
Catalog Number:
AG007XO8
Chemical Name:
1H-IMIDAZOLE, 1-[(4-METHYLPHENYL)SULFONYL]-2-PHENYL-
CAS Number:
150205-84-8
Molecular Formula:
C16H14N2O2S
Molecular Weight:
298.3596
IUPAC Name:
1-(4-methylphenyl)sulfonyl-2-phenylimidazole
InChI:
InChI=1S/C16H14N2O2S/c1-13-7-9-15(10-8-13)21(19,20)18-12-11-17-16(18)14-5-3-2-4-6-14/h2-12H,1H3
InChI Key:
PVASNXLRVSGJJG-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)S(=O)(=O)n1ccnc1c1ccccc1
Properties
Complexity:
432
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
298.078g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
298.36g/mol
Monoisotopic Mass:
298.078g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
60.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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