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136994-91-7

136994-91-7 | 1H,3H-Thiazolo[3,4-a]benzimidazole, 1-(4-fluorophenyl)-

CAS No: 136994-91-7 Catalog No: AG0012NV MDL No:

Product Description

Catalog Number:
AG0012NV
Chemical Name:
1H,3H-Thiazolo[3,4-a]benzimidazole, 1-(4-fluorophenyl)-
CAS Number:
136994-91-7
Molecular Formula:
C15H11FN2S
Molecular Weight:
270.3246
IUPAC Name:
1-(4-fluorophenyl)-1,3-dihydro-[1,3]thiazolo[3,4-a]benzimidazole
InChI:
InChI=1S/C15H11FN2S/c16-11-7-5-10(6-8-11)15-18-13-4-2-1-3-12(13)17-14(18)9-19-15/h1-8,15H,9H2
InChI Key:
TUEVGHMVASKCCE-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1)C1SCc2n1c1ccccc1n2
NSC Number:
625473

Properties

Complexity:
332  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.063g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
270.325g/mol
Monoisotopic Mass:
270.063g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  

Literature

Title Journal
Anti-HIV agents. I: Synthesis and in vitro anti-HIV evaluation of novel 1H,3H-thiazolo[3,4-a]benzimidazoles. Farmaco (Societa chimica italiana : 1989) 19910601

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