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HUHS015

CAS No.:
1453097-13-6
Catalog Number:
AG00ABSF
Molecular Formula:
C19H18N4O
Molecular Weight:
318.3724
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5mg
99%
1 week
United States
$154
- +
10mg
99%
1 week
United States
$196
- +
50mg
99%
1 week
United States
$460
- +
100mg
99%
1 week
United States
$737
- +
Product Description
Catalog Number:
AG00ABSF
Chemical Name:
HUHS015
CAS Number:
1453097-13-6
Molecular Formula:
C19H18N4O
Molecular Weight:
318.3724
MDL Number:
MFCD28502088
IUPAC Name:
4-benzyl-5-methyl-2-(6-methyl-1H-benzimidazol-2-yl)-1H-pyrazol-3-one
InChI:
InChI=1S/C19H18N4O/c1-12-8-9-16-17(10-12)21-19(20-16)23-18(24)15(13(2)22-23)11-14-6-4-3-5-7-14/h3-10,22H,11H2,1-2H3,(H,20,21)
InChI Key:
IQOKQFQFGHZHJT-UHFFFAOYSA-N
SMILES:
Cc1ccc2c(c1)[nH]c(n2)n1nc(c(c1O)Cc1ccccc1)C
Properties
Complexity:
526  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
318.148g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
318.38g/mol
Monoisotopic Mass:
318.148g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
61A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4  
Properties