200,000+ products from a single source!
sales@angenechem.com
Home > Imidazoles > 53704-78-2
53704-78-2 | 1-BENZYL-5-PHENYL-1,3-DIHYDRO-2H-IMIDAZOLE-2-THIONE
CAS No: 53704-78-2 Catalog No: AG01AR7T MDL No:MFCD09039893
Product Description
Catalog Number:
AG01AR7T
Chemical Name:
1-BENZYL-5-PHENYL-1,3-DIHYDRO-2H-IMIDAZOLE-2-THIONE
CAS Number:
53704-78-2
Molecular Formula:
C16H14N2S
Molecular Weight:
266.3608
MDL Number:
MFCD09039893
IUPAC Name:
3-benzyl-4-phenyl-1H-imidazole-2-thione
InChI:
InChI=1S/C16H14N2S/c19-16-17-11-15(14-9-5-2-6-10-14)18(16)12-13-7-3-1-4-8-13/h1-11H,12H2,(H,17,19)
InChI Key:
KAVVVQZQAWVEKR-UHFFFAOYSA-N
SMILES:
Sc1ncc(n1Cc1ccccc1)c1ccccc1
Properties
Complexity:
352
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.088g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
266.362g/mol
Monoisotopic Mass:
266.088g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
47.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.