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L189

CAS No.:
64232-83-3
Catalog Number:
AG00EBM6
Molecular Formula:
C11H10N4OS
Molecular Weight:
246.2883
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5mg
≥95%
1 week
United States
$153
- +
10mg
98%
1 week
United States
$207
- +
25mg
≥95%
1 week
United States
$489
- +
50mg
98%
1 week
United States
$640
- +
Product Description
Catalog Number:
AG00EBM6
Chemical Name:
L189
CAS Number:
64232-83-3
Molecular Formula:
C11H10N4OS
Molecular Weight:
246.2883
MDL Number:
MFCD11556233
IUPAC Name:
6-amino-5-(benzylideneamino)-2-sulfanylidene-1H-pyrimidin-4-one
InChI:
InChI=1S/C11H10N4OS/c12-9-8(10(16)15-11(17)14-9)13-6-7-4-2-1-3-5-7/h1-6H,(H4,12,14,15,16,17)
InChI Key:
SAKOXVNKDMWWLF-UHFFFAOYSA-N
SMILES:
Nc1[nH]c(=S)[nH]c(=O)c1N=Cc1ccccc1
Properties
Complexity:
396  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.058g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
246.288g/mol
Monoisotopic Mass:
246.058g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
112A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  
Properties