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1105188-88-2

1105188-88-2 | 1-(2-Furylmethyl)-5-(4-methylphenyl)-1H-imidazole-2-thiol

CAS No: 1105188-88-2 Catalog No: AG01ARX1 MDL No:MFCD11986818

Product Description

Catalog Number:
AG01ARX1
Chemical Name:
1-(2-Furylmethyl)-5-(4-methylphenyl)-1H-imidazole-2-thiol
CAS Number:
1105188-88-2
Molecular Formula:
C15H14N2OS
Molecular Weight:
270.3495
MDL Number:
MFCD11986818
IUPAC Name:
3-(furan-2-ylmethyl)-4-(4-methylphenyl)-1H-imidazole-2-thione
InChI:
InChI=1S/C15H14N2OS/c1-11-4-6-12(7-5-11)14-9-16-15(19)17(14)10-13-3-2-8-18-13/h2-9H,10H2,1H3,(H,16,19)
InChI Key:
DGQJUBRJYRMSGH-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)c1cnc(n1Cc1ccco1)S

Properties

Complexity:
374  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.083g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
270.35g/mol
Monoisotopic Mass:
270.083g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
60.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  

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