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Zaltidine

CAS No.:
85604-00-8
Catalog Number:
AG00G3IF
Molecular Formula:
C8H10N6S
Molecular Weight:
222.2702
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5mg
99%
1 week
United States
$457
- +
10mg
99%
1 week
United States
$723
- +
50mg
99%
1 week
United States
$2057
- +
Product Description
Catalog Number:
AG00G3IF
Chemical Name:
Zaltidine
CAS Number:
85604-00-8
Molecular Formula:
C8H10N6S
Molecular Weight:
222.2702
MDL Number:
MFCD00867514
IUPAC Name:
2-[4-(2-methyl-1H-imidazol-5-yl)-1,3-thiazol-2-yl]guanidine
InChI:
InChI=1S/C8H10N6S/c1-4-11-2-5(12-4)6-3-15-8(13-6)14-7(9)10/h2-3H,1H3,(H,11,12)(H4,9,10,13,14)
InChI Key:
GIMNAEMRNXUAQP-UHFFFAOYSA-N
SMILES:
NC(=N)Nc1scc(n1)c1cnc([nH]1)C
UNII:
54HY424479
Properties
Complexity:
254  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.069g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
222.27g/mol
Monoisotopic Mass:
222.069g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
134A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
Literature
Title Journal
ElogD(oct): a tool for lipophilicity determination in drug discovery. 2. Basic and neutral compounds. Journal of medicinal chemistry 20010719
Properties