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1012059-50-5

1012059-50-5 | 2H-IMidazo[4,5-c]pyridine-2-thione, 4-aMino-1,3-dihydro-1-[(4-Methoxyphenyl)Methyl]-

CAS No: 1012059-50-5 Catalog No: AG0003Y1 MDL No:

Product Description

Catalog Number:
AG0003Y1
Chemical Name:
2H-IMidazo[4,5-c]pyridine-2-thione, 4-aMino-1,3-dihydro-1-[(4-Methoxyphenyl)Methyl]-
CAS Number:
1012059-50-5
Molecular Formula:
C14H14N4OS
Molecular Weight:
286.3522
IUPAC Name:
4-amino-1-[(4-methoxyphenyl)methyl]-3H-imidazo[4,5-c]pyridine-2-thione
InChI:
InChI=1S/C14H14N4OS/c1-19-10-4-2-9(3-5-10)8-18-11-6-7-16-13(15)12(11)17-14(18)20/h2-7H,8H2,1H3,(H2,15,16)(H,17,20)
InChI Key:
WNYBGSQHYDNPIE-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)Cn1c(=S)[nH]c2c1ccnc2N

Properties

Complexity:
359  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.089g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
286.353g/mol
Monoisotopic Mass:
286.089g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
95.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  

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