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Home Carboxys Pyrimidine-4-carboxylic acid hydrazide

Pyrimidine-4-carboxylic acid hydrazide

CAS No.:
39513-54-7
Catalog Number:
AG00BYVO
Molecular Formula:
C5H6N4O
Molecular Weight:
138.1273
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$125
- +
5g
98%
In Stock USA
United States
$407
- +
10g
98%
In Stock USA
United States
$650
- +
25g
98%
In Stock USA
United States
$1275
- +
Product Description
Catalog Number:
AG00BYVO
Chemical Name:
Pyrimidine-4-carboxylic acid hydrazide
CAS Number:
39513-54-7
Molecular Formula:
C5H6N4O
Molecular Weight:
138.1273
MDL Number:
MFCD06738862
IUPAC Name:
pyrimidine-4-carbohydrazide
InChI:
InChI=1S/C5H6N4O/c6-9-5(10)4-1-2-7-3-8-4/h1-3H,6H2,(H,9,10)
InChI Key:
NWTQBXDLKZTWAH-UHFFFAOYSA-N
SMILES:
NNC(=O)c1ccncn1
Properties
Complexity:
127  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
138.054g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
138.13g/mol
Monoisotopic Mass:
138.054g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
80.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1  
Literature
Title Journal
Rational design of new antituberculosis agents: receptor-independent four-dimensional quantitative structure-activity relationship analysis of a set of isoniazid derivatives. Journal of medicinal chemistry 20040715
Properties